Shanghai Pesticide Research Institute

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Profile: Shanghai Pesticide Research Institute specializes in providing agrochemcials, fine chemcicals, bio medical and APIs. Agro chemcials include chlorfenapyr, empenthrin, methylamino abamectin, pyrimethanil, flazasulfuron, pendimethalin and diflufenican. Fine chemicals include 2,6-dichloro-5-fluoro-3-pyridinecarbonitrile, 2,6-dichloro-5-fluoronicotinic acid, 2-amino-6-chloropurine, 2-chloro-5-fluoronicotinic acid, 2-chloroacrylic acid and 4-bromo-3-fluorobenzotrifluoride.

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• Acetoacetic Acid Methyl Ester

IUPAC Name: methyl 3-oxobutanoate | CAS Registry Number: 105-45-3
Synonyms: Methyl 3-oxobutanoate, Methylacetoacetate, Methyl acetylacetate, Methyl 3-oxobutyrate, METHYL ACETOACETATE, Methyl acetylacetonate, Acetoacetic methyl ester, Acetoacetic acid, methyl ester, Acetoacetic acid methyl ester, 1-Methoxybutane-1,3-dione, Butanoic acid, 3-oxo-, methyl ester, 3-Oxobutanoic acid methyl ester, CCRIS 2302, HSDB 1083, 537365_ALDRICH, 00500_FLUKA, 10913_FLUKA, 14610_FLUKA, EINECS 203-299-8, Methylester kyseliny acetoctove [Czech]

Molecular Formula:	C₅H₈O₃	Molecular Weight:	116.115220 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: WRQNANDWMGAFTP-UHFFFAOYSA-N

• Acetyl Hydrazide

IUPAC Name: acetohydrazide | CAS Registry Number: 1068-57-1
Synonyms: Acethydrazide, Acetylhydrazine, Acetohydrazide, Acetic hydrazide, Monoacetylhydrazine, Acetyl hydrazide, Acetyl hydrazine, N-Acetylhydrazine, Acetic acid hydrazide, Monoacetyl hydrazine, acethydrazine, acetylhydrazide, Ethanehydrazonic acid, Hydrazine, acetyl-, N-Acetyldiamine, AcN2 deriv, ACETIC ACID, HYDRAZIDE, acetohydrazonic acid, WLN: ZMV1, A8309_ALDRICH

Molecular Formula:	C₂H₆N₂O	Molecular Weight:	74.081840 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: OFLXLNCGODUUOT-UHFFFAOYSA-N

• Anisole

IUPAC Name: methoxybenzene | CAS Registry Number: 100-66-3
Synonyms: Methoxybenzene, ANISOLE, Benzene, methoxy-, Methyl phenyl ether, Anizol, Phenoxymethane, Benzene, methoxy, Anisol, Phenol methyl ether, Phenyl methyl ether, Ether, methyl phenyl, FEMA Number 2097, Ether, methyl phenyl-, HSDB 44, FEMA No. 2097, WLN: 1OR, 296295_ALDRICH, NSC 7920, 10520_FLUKA, 96109_FLUKA

Molecular Formula:	C₇H₈O	Molecular Weight:	108.137820 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: RDOXTESZEPMUJZ-UHFFFAOYSA-N

• Atrazine

IUPAC Name: 6-chloro-4-N-ethyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine | CAS Registry Number: 1912-24-9
Synonyms: atrazine, Oleogesaprim, Chromozin, Atazinax, Atrasine, Fenatrol, Gesaprim, Gesoprim, Hungazin, Primatol, Strazine, Aktikon, Argezin, Atranex, Atrazin, Fenamin, Pitezin, Primaze, Radazin, Zeazine

Molecular Formula:	C₈H₁₄ClN₅	Molecular Weight:	215.683260 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	5

InChIKey: MXWJVTOOROXGIU-UHFFFAOYSA-N

• Benzyl Amine Hydrochloride

IUPAC Name: phenylmethanamine hydrochloride | CAS Registry Number: 3287-99-8
Synonyms: Phenylmethylamine, Benzylamine hydrochloride, BENZYLAMINE HCl, USAF EL-82, WLN: Z1R &GH, MLS001332427, MLS001332428, B5136_SIGMA, Benzenemethanamine, hydrochloride, BENZYLAMINE, HYDROCHLORIDE, NSC146463, SMR000875242

Molecular Formula:	C₇H₁₀ClN	Molecular Weight:	143.614000 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	1

InChIKey: XKXHCNPAFAXVRZ-UHFFFAOYSA-N

• Benzyl Bromide

IUPAC Name: bromomethylbenzene | CAS Registry Number: 100-39-0
Synonyms: alpha-Bromotoluene, 1-Bromotoluene, (Bromomethyl)benzene, Cyclite, BENZYL BROMIDE, Bromophenylmethane, Benzene, (bromomethyl)-, Ambap7, bromomethyl-benzene, BROMOTOLUENE, Benzene, bromomethyl-, Toluene, alpha-bromo-, .alpha.-Bromotoluene, .omega.-Bromotoluene, Toluene, .alpha.-bromo-, TOLUENE,ALPHA-BROMO, WLN: E1R, CCRIS 5980, HSDB 369, B17905_ALDRICH

Molecular Formula:	C₇H₇Br	Molecular Weight:	171.034480 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: AGEZXYOZHKGVCM-UHFFFAOYSA-N

• Benzyl Chloroformate In Toluene

IUPAC Name: phenylmethyl carbonochloridate | CAS Registry Number: 501-53-1
Synonyms: Cbz chloride, Carbobenzoxy chloride, Benzyl chlorocarbonate, BENZYL CHLOROFORMATE, Z-chloride, Benzylcarbonyl chloride, Carbobenzyloxy chloride, Benzyl carbonochloridate, Benzylcarbonochloridate, Benzyloxycarbonyl chloride, Benzyl chloridocarbonate, Ambap1428, Chloroformic acid, benzyl ester, WLN: GVO1R, CCRIS 2599, HSDB 364, Carbonochloridic acid, phenylmethyl ester, Formic acid, chloro-, benzyl ester, 119938_ALDRICH, Carbonochloride acid benzylester

Molecular Formula:	C₈H₇ClO₂	Molecular Weight:	170.592980 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: HSDAJNMJOMSNEV-UHFFFAOYSA-N

• Beta Sitosterol

IUPAC Name: (3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | CAS Registry Number: 83-46-5
Synonyms: Sitosterol, BETA-SITOSTEROL, Quebrachol, Angelicin, Cinchol, Cupreol, Rhamnol, Harzol, Triastonal, Sitosterol beta, Sito-Lande, .beta.Sitosterin, .beta.Sitosterol, Steroids, hydroxy, Refined soy sterol, .beta.-Sitosterin, .beta.-Sitosterol, Angelicin (steroid), alpha-Dihydrofucosterol, alpha.Dihydrofucosterol

Molecular Formula:	C₂₉H₅₀O	Molecular Weight:	414.706700 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: KZJWDPNRJALLNS-VJSFXXLFSA-N

• Beta-Cypermethrin

IUPAC Name: [(S)-cyano-[3-(phenoxy)phenyl]methyl] (1R,3R)-3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate | CAS Registry Number: 65731-84-2
Synonyms: NRDC 168S, CHEBI:39336, (1R)-cis-(alphaS)-cypermethrin, EINECS 265-898-0, (S)-cyano(3-phenoxyphenyl)methyl (1R,3R)-3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropanecarboxylate, alpha-Cyano-3-phenoxybenzyl (1R-(1alpha(S*),3alpha))-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate, Cyclopropanecarboxylic acid, 3-(2,2-dichloroethenyl)-2,2-dimethyl-, cyano(3-phenoxyphenyl)methyl ester, (1R-(1alpha(S*),3alpha))-

Molecular Formula:	C₂₂H₁₉Cl₂NO₃	Molecular Weight:	416.297160 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: KAATUXNTWXVJKI-NSHGMRRFSA-N

• Bit (1,2-Benzisothiazolin-3-One)

IUPAC Name: 1,2-benzothiazol-3-one | CAS Registry Number: 2634-33-5
Synonyms: Proxan, Proxel PL, Proxel, benzisothiazolone, Caswell No. 079A, Caswell No. 513A, 1,2-Benzisothiazol-3(2H)-one, C7H5NOS, 1,2-Benzisothiazolin-3-one, 1,2-Benzisothiazoline-3-one, CCRIS 6369, MLS000771034, 561487_ALDRICH, EINECS 220-120-9, 1,2-BIT, 1,2-BENZISOTHIAZOL-3-ONE, EPA Pesticide Chemical Code 098901, ZINC02035984, NCGC00164206-01, LS-33607

Molecular Formula:	C₇H₅NOS	Molecular Weight:	151.185700 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: DMSMPAJRVJJAGA-UHFFFAOYSA-N

• BOC-L-Alanine

IUPAC Name: (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid | CAS Registry Number: 15761-38-3
Synonyms: Boc-l-alanine, Boc-Ala-OH, Boc-DL-Ala-OH, Boc-Ala-OH-12C3, 134511_ALDRICH, 492884_ALDRICH, 15380_FLUKA, N-(tert-Butoxycarbonyl)-L-alanine, EINECS 239-847-8, SBB016767, L-Alanine-12C3, N-t-Boc derivative, N-(tert-Butoxycarbonyl)-L-alanine-12C3, TL8002752, N-((1,1-Dimethylethoxy)carbonyl)-L-alanine, L-Alanine, N-((1,1-dimethylethoxy)carbonyl)-, 186665-28-1, 207305-56-4, 90580-61-3

Molecular Formula:	C₈H₁₅NO₄	Molecular Weight:	189.209000 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: QVHJQCGUWFKTSE-YFKPBYRVSA-N

• Carmazine

IUPAC Name: zinc; manganese(2+); N-[2-(sulfidocarbothioylamino)ethyl]carbamodithioate | CAS Registry Number: 8018-01-7
Synonyms: Dithane, Manzeb, MANCOZEB, 1,2-Ethanedicarbamic acid, tetrathio-, ethylenebisdithiocarbamate manganese-zinc, NCGC00168344-01, LS-63091, C15225, C013099, manganese(2+) ethane-1,2-diylbis(dithiocarbamate) zinc ethane-1,2-diylbis(dithiocarbamate), 12656-69-8, 172672-41-2

Molecular Formula:	C₈H₁₂MnN₄S₈Zn	Molecular Weight:	541.074729 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	4

InChIKey: CHNQZRKUZPNOOH-UHFFFAOYSA-J

• Chlorpyrifos

IUPAC Name: diethoxy-sulfanylidene-(3,5,6-trichloropyridin-2-yl)oxy-$l^{5}-phosphane | CAS Registry Number: 2921-88-2
Synonyms: chlorpyrifos, Chlorpyriphos, Dursban, Trichlorpyrphos, Lorsban, Killmaster, Danusban, Dhanusban, Geodinfos, Piridane, Bonidel, Coroban, Lentrek, Pyrinex, Spannit, Stipend, Tafaban, Brodan, Durmet, Equity

Molecular Formula:	C₉H₁₁Cl₃NO₃PS	Molecular Weight:	350.586301 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: SBPBAQFWLVIOKP-UHFFFAOYSA-N

• Citric Acid Monohydrate

IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylic acid hydrate | CAS Registry Number: 5949-29-1
Synonyms: citric acid, Citric acid hydrate, Citric acid monohydrate, Citric acid (TN), Citric acid (JP15), CITRIC ACID, MONOHYDRATE, Citric acid monohydrate (USP), CID22230, LS-54370, C12649, D01222, 1,2,3-Propanetricarboxylic acid, 2-hydroxy-, monohydrate

Molecular Formula:	C₆H₁₀O₈	Molecular Weight:	210.138800 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	8

InChIKey: YASYEJJMZJALEJ-UHFFFAOYSA-N

• Cyclohexyl Isocyanate

IUPAC Name: isocyanatocyclohexane | CAS Registry Number: 3173-53-3
Synonyms: Cyclohexyl isocyanate, Cyclohexane, isocyanato-, Cyclohexylisocyanate, ISOCYANATOCYCLOHEXANE, Isocyanic acid, cyclohexyl ester, CYCLOHEXYL,ISOCYANATE, C105198_ALDRICH, EINECS 221-639-3, NSC 87419, UN2488, NSC87419, ZINC01562082, AI3-28283, LS-1186, NCGC00090947-01, NCGC00090947-02, Cyclohexyl isocyanate [UN2488] [Poison], Cyclohexyl isocyanate [UN2488] [Poison], InChI=1/C7H11NO/c9-6-8-7-4-2-1-3-5-7/h7H,1-5H

Molecular Formula:	C₇H₁₁NO	Molecular Weight:	125.168340 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: KQWGXHWJMSMDJJ-UHFFFAOYSA-N

• D(-)-Tartaric Acid

IUPAC Name: (2S,3S)-2,3-dihydroxybutanedioic acid | CAS Registry Number: 147-71-7
Synonyms: d-Tartaric acid, D-threaric acid, Linksweinsaeure, D-Tartrate, 1rpa, DL-Tartaric acid, (-)-Tartaric acid, (-)-Weinsaeure, (S,S)-Tartrate, (S,S)-Tartaric acid, (-)-D-Tartaric acid, (2S,3S)-Tartaric acid, D-( )-Tartaric acid, D-(-)-Tartaric acid, D(-)-TARTARIC ACID, T206_ALDRICH, T400_ALDRICH, NCIStruc1_000172, NCIStruc2_000222, MLS001076664

Molecular Formula:	C₄H₆O₆	Molecular Weight:	150.086840 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	6

InChIKey: FEWJPZIEWOKRBE-LWMBPPNESA-N

• D-Leucinol

IUPAC Name: 2-amino-4-methylpentan-1-ol | CAS Registry Number: 53448-09-2
Synonyms: Leucinol, DL-Leucinol, (R)-(-)-Leucinol, (S)-(+)-Leucinol, 1-Pentanol, 2-amino-4-methyl-, 2-Amino-4-methyl-1-pentanol, 2-Amino-4-methylpentan-1-ol, l-2-Amino-4-methyl-1-pentanol, CID79030, NSC64339, EINECS 207-933-4, 1-Pentanol, 2-amino-4-methyl-, (S)-, 1-Pentanol, 2-amino-4-methyl-, (.+/-.)-, 16369-17-8, 502-32-9

Molecular Formula:	C₆H₁₅NO	Molecular Weight:	117.189400 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: VPSSPAXIFBTOHY-UHFFFAOYSA-N

• D-Phenothrin

IUPAC Name: [3-(phenoxy)phenyl]methyl (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate | CAS Registry Number: 26046-85-5
Synonyms: d-trans-Phenothrin, (1R)-trans-Phenothrin, CHEBI:39405, EINECS 247-431-2, phenothrin [(1R)-trans- isomer], LS-58714, LS-58716, LS-58717, m-Phenoxybenzyl (1R-trans)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxylate, Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, (3-phenoxyphenyl)methyl ester, (1R-trans)-, 3-phenoxybenzyl (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarboxylate, 51186-86-8, Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, (3-phenoxyphenyl)methyl ester, trans-(+-)-

Molecular Formula:	C₂₃H₂₆O₃	Molecular Weight:	350.450740 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: SBNFWQZLDJGRLK-RTWAWAEBSA-N

• D-Phenylalanine

IUPAC Name: (2R)-2-amino-3-phenylpropanoic acid | CAS Registry Number: 673-06-3
Synonyms: D-phenylalanine, Sabiden, phenylalanine, Phenylalanine D-form, Alanine, phenyl-, D-, DL-PHNYLALANINE, Spectrum_001725, Spectrum2_001558, Spectrum4_000865, Spectrum5_001137, CCRIS 6267, D-beta-Phenyl-alpha-alanine, KBioGR_001529, KBioSS_002205, DivK1c_000453, P1751_SIGMA, SPECTRUM1503391, SPBio_001436, NCI-C60195, CHEBI:16998

Molecular Formula:	C₉H₁₁NO₂	Molecular Weight:	165.189140 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: COLNVLDHVKWLRT-MRVPVSSYSA-N

• D-Tetramethrin

IUPAC Name: (1,3-dioxo-4,5,6,7-tetrahydroisoindol-2-yl)methyl (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate | CAS Registry Number: 1166-46-7
Synonyms: Tetramethrin, Bioneopynamin, Tetramethrine, Neopinamin, Phthalthrin, Insectol, Multicide, Tetralate, d-Tetramethrin, d-Phthalthrin, Neo-pynamin, Neopynamin forte, Weo-Pynamin, Tetramethrinum, Tetrametrina, Py-Kill, Tetramethrin,racemic, Niagara nia-9260, Caswell No. 844, Sumitomo SP-1103

Molecular Formula:	C₁₉H₂₅NO₄	Molecular Weight:	331.406100 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: CXBMCYHAMVGWJQ-CABCVRRESA-N

• Di-Tert Butyl Dicarbonate

IUPAC Name: tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate | CAS Registry Number: 24424-99-5
Synonyms: BOC-anhydride, Di-tert-butyl dicarbonate, BOC anhydride, tert-Butyl dicarbonate, Boc2O, Di(tert-butyl) carbonate, Di-tert-butyldicarbonate, di-t-Butyl dicarbonate, tert-Butoxycarbonyl anhydride, Bis(tert-butoxycarbonyl)oxide, di-tert-Butyl pyrocarbonate, CCRIS 2598, 205249_ALDRICH, 361941_ALDRICH, 436267_ALDRICH, 34660_FLUKA, CHEBI:48500, EINECS 246-240-1, Pyrocarbonic acid di-tert-butyl ester, Di-tert-butyl dicarbonate solution

Molecular Formula:	C₁₀H₁₈O₅	Molecular Weight:	218.246920 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	5

InChIKey: DYHSDKLCOJIUFX-UHFFFAOYSA-N

• Diacetone Glucose

IUPAC Name: (3aR,5S,6S,6aR)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-ol | CAS Registry Number: 582-52-5
Synonyms: Diacetoneglucose, ZINC03956910, CID7067560, 1,2,4,6-DIACETONE-D-GLUCOSE

Molecular Formula:	C₁₂H₂₀O₆	Molecular Weight:	260.283600 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	6

InChIKey: KEJGAYKWRDILTF-JDDHQFAOSA-N

• Diacetyl, Natural

IUPAC Name: butane-2,3-dione | CAS Registry Number: 431-03-8
Synonyms: biacetyl, 2,3-butanedione, diacetyl, dimethylglyoxal, Butanedione, Dimethyl glyoxal, butadione, dimethyl diketone, 2,3-diketobutane, 2,3-Butadione, 2,3-dioxobutane, Glyoxal, dimethyl-, Diketobutane, Diacetyl (natural), Dimethyldiketone, Acetoacetaldehyde, Butane-2,3-dione, 2,3-butandione, 2,3 Butanedione, Butan-2,3-dione

Molecular Formula:	C₄H₆O₂	Molecular Weight:	86.089240 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: QSJXEFYPDANLFS-UHFFFAOYSA-N

• Endosulfan

Synonyms: endosulfan, Benzoepin, Thiodan, Thionex, Chlorthiepin, Insectophene, Rasayansulfan, Devisulphan, Endosulphan, Thiosulfan, Crisulfan, Thionate, Endocel, Endotaf, Thiotox, Beosit, Hildan, Phaser, Sialan, Thifor

Molecular Formula:	C₉H₆Cl₆O₃S	Molecular Weight:	406.925140 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: RDYMFSUJUZBWLH-UHFFFAOYSA-N

• Ethanesulfonyl Chloride

IUPAC Name: ethanesulfonyl chloride | CAS Registry Number: 594-44-5
Synonyms: Ethylsulfochloride, Ethylsulfonyl chloride, ETHANESULFONYL CHLORIDE, 1-Ethanesulfonyl chloride, Ethanesulphonyl chloride, WLN: WSG2, TL 77, 471542_ALDRICH, NSC 8649, 02420_FLUKA, 02422_FLUKA, EINECS 209-842-5, NSC8649, CID11667, BRN 0773865, ETHANESULFONYL CHLORIDE, PRACT, LS-65687, 4-04-00-00034 (Beilstein Handbook Reference), InChI=1/C2H5ClO2S/c1-2-6(3,4)5/h2H2,1H

Molecular Formula:	C₂H₅ClO₂S	Molecular Weight:	128.577900 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: FRYHCSODNHYDPU-UHFFFAOYSA-N

• Ethyl 4-Bromobutyrate

IUPAC Name: ethyl 4-bromobutanoate | CAS Registry Number: 2969-81-5
Synonyms: Ethyl 4-bromobutyrate, Ethyl 4-bromobutanoate, BrCH2CH2CH2C(O)OC2H5, 167118_ALDRICH, EINECS 221-005-6, NSC133462, ZINC01720175, Butanoic acid, 4-bromo-, ethyl ester, NSC 133462, AI3-36601, Butanoic acid, 4-bromo-, ethyl ester (9CI), B-5800

Molecular Formula:	C₆H₁₁BrO₂	Molecular Weight:	195.054340 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: XBPOBCXHALHJFP-UHFFFAOYSA-N

• Ethyl Bromoacetate

IUPAC Name: ethyl 2-bromoacetate | CAS Registry Number: 105-36-2
Synonyms: Ethyl bromoacetate, Antol, Ethyl bromacetate, Ethyl monobromoacetate, Ethyl alpha-bromoacetate, Ethoxycarbonylmethyl bromide, Acetic acid, bromo-, ethyl ester, ETHYL 2-BROMOACETATE, Bromoacetic acid, ethyl ester, Ethyl .alpha.-bromoacetate, Bromoacetic acid ethyl ester, CCRIS 6802, WLN: E1VO2, HSDB 5069, 133973_ALDRICH, NSC 8832, 17020_FLUKA, EINECS 203-290-9, NSC8832, UN1603

Molecular Formula:	C₄H₇BrO₂	Molecular Weight:	167.001180 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: PQJJJMRNHATNKG-UHFFFAOYSA-N

• Ethyl Lactate

IUPAC Name: ethyl 2-hydroxypropanoate | CAS Registry Number: 97-64-3
Synonyms: Solactol, Actylol, Acytol, Lactic acid, ethyl ester, Lactate d'ethyle, ETHYL LACTATE, Ethyl 2-hydroxypropanoate, Ethyl lactate (natural), Ethyl 2-hydroxypropionate, Lactate d'ethyle [French], Ethyl (S)-(-)-lactate, Ethyl alpha-hydroxypropionate, FEMA No. 2440, HSDB 412, Propanoic acid, 2-hydroxy-, ethyl ester, (-)-ETHYL L-LACTATE, Ethyl .alpha.-hydroxypropionate, WLN: QVY1 & O2, Ethylester kyseliny mlecne [Czech], 2-Hydroxypropanoic acid ethyl ester

Molecular Formula:	C₅H₁₀O₃	Molecular Weight:	118.131100 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: LZCLXQDLBQLTDK-UHFFFAOYSA-N

• Ethyl Oxalyl Chloride

IUPAC Name: ethyl 2-chloro-2-oxoacetate | CAS Registry Number: 4755-77-5
Synonyms: Ethoxalyl chloride, Ethyl chlorooxoacetate, Ethyl oxalyl chloride, Ethoxy oxalylchloride, Monoethyl oxaloyl chloride, ETHYL CHLOROGLYOXYLATE, Monoethyl oxalyl chloride, Oxalyl chloride, ethyl ester, Ethyl 2-chloro-2-oxoacetate, mono-Ethyl oxalyl chloride, E43101_ALDRICH, Oxalic acid monoethyl ester chloride, 75753_FLUKA, Acetic acid, chlorooxo-, ethyl ester, Glyoxylic acid, chloro-, ethyl ester, NSC80644, EINECS 225-285-0, NSC 80644, ZINC01639557

Molecular Formula:	C₄H₅ClO₃	Molecular Weight:	136.533700 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: OWZFULPEVHKEKS-UHFFFAOYSA-N

• Ethyl Phenyl Glycidate

IUPAC Name: ethyl 3-phenyloxirane-2-carboxylate | CAS Registry Number: 121-39-1
Synonyms: Ethyl 3-phenylglycidate, Ethyl phenylglycidate, 2-Ethyl-3-phenylglycidate, FEMA No. 2454, CCRIS 2623, Glycidic acid, 3-phenyl-, ethyl ester, NCIOpen2_001041, Ethyl 3-phenyloxiranecarboxylate, 3-Phenylglycidic acid, ethyl ester, HSDB 5404, Ethyl 3-phenyloxirane-2-carboxylate, W245402_ALDRICH, 291404_ALDRICH, Ethyl alpha,beta-epoxyhydrocinnamate, NSC 8899, EINECS 204-467-3, Ethyl 3-phenyl-2,3-epoxypropionate, NSC8899, Oxiranecarboxylic acid, 3-phenyl-, ethyl ester, BRN 0163394

Molecular Formula:	C₁₁H₁₂O₃	Molecular Weight:	192.211180 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: GOMAKLPNAAZVCJ-UHFFFAOYSA-N

• Fast Bordeaux Gp Base

IUPAC Name: 4-methoxy-2-nitroaniline | CAS Registry Number: 96-96-8
Synonyms: 2-Nitro-p-anisidine, Azobase NAS, Devol Bordeaux B, Bordeaux GP Base, Bordeaux GP Salt, Fast Bordeaux GP, 4-Methoxy-2-nitroaniline, Bordeaux Base NGP, Bordeaux GPS Salt, Bordeaux Salt NGP, Fast Bordeaux GDN, Azofix Bordeaux GP, 4-Amino-3-nitroanisole, Diabase Bordeaux GP, Diasalt Bordeaux GP, Lake Maroon B Base, p-Anisidine, 2-nitro-, Pharmasol Bordeaux GP, Fast Bordeaux Base J, Fast Bordeaux Salt J

Molecular Formula:	C₇H₈N₂O₃	Molecular Weight:	168.150020 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: QFMJFXFXQAFGBO-UHFFFAOYSA-N

• Glucono-Lactone

IUPAC Name: (3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-one | CAS Registry Number: 90-80-2
Synonyms: gluconolactone, delta-gluconolactone, D-Aldonolactone, Gluconic lactone, D-Gluconolactone, Glucarolactone, 1,5-Gluconolactone, D-glucono-1,5-lactone, Gluconic acid lactone, Deltagluconolactone, Glucono delta lactone, Glucono delta-lactone, Gluconic delta-lactone, delta-D-Gluconolactone, 1,5-D-Gluconolactone, D-Gluconic acid lactone, D-delta-Gluconolactone, D-glucono-delta-lactone, glucono-delta-lactone, glucono-1,5-lactone

Molecular Formula:	C₆H₁₀O₆	Molecular Weight:	178.140000 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	6

InChIKey: PHOQVHQSTUBQQK-SQOUGZDYSA-N

• Glycine tert butyl ester hydrochloride

IUPAC Name: [2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]azanium | CAS Registry Number: 27532-96-3
Synonyms: ZINC00389678, CID6950361

Molecular Formula:	C₆H₁₄NO₂+	Molecular Weight:	132.180860 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: SJMDMGHPMLKLHQ-UHFFFAOYSA-O

• Glycolic Acid

IUPAC Name: 2-hydroxyacetic acid | CAS Registry Number: 79-14-1
Synonyms: glycolic acid, hydroxyacetic acid, glycolate, Glycollic acid, Hydroxyethanoic acid, Acetic acid, hydroxy-, Polyglycolide, Glycocide, 2-Hydroxyacetic acid, GlyPure, Caswell No. 470, Polyglycollic acid, Dexon (polyester), GlyPure 70, GLYCOLLATE, POLYGLYCOLIC ACID, Glycolic acid solution, Poly(L-glycolic acid), alpha-Hydroxyacetic acid, 1-hydroxy-ethanoic acid

Molecular Formula:	C₂H₄O₃	Molecular Weight:	76.051360 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: AEMRFAOFKBGASW-UHFFFAOYSA-N

• Glyphosate

IUPAC Name: 2-(phosphonomethylamino)acetic acid | CAS Registry Number: 1071-83-6
Synonyms: glyphosate, Glyphosphate, Pondmaster, Roundup, gliphosate, Silglif, Roundup Max, N-(Phosphonomethyl)glycine, 2gga, 2ggd, Anti-BOB, Caswell No. 661A, Isopropylamine glyphosate, Glyphosate, free acid, N-Phosphonomethylglycine, Spectrum_001867, SpecPlus_000478, Spectrum2_001847, Spectrum3_000839, Spectrum4_000679

Molecular Formula:	C₃H₈NO₅P	Molecular Weight:	169.073081 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	6

InChIKey: XDDAORKBJWWYJS-UHFFFAOYSA-N

• Hydrangin

IUPAC Name: 7-hydroxychromen-2-one | CAS Registry Number: 93-35-6
Synonyms: Umbelliferone, 7-hydroxycoumarin, Skimmetin, 7-Oxycoumarin, Umbelliferon, Hydrangine, Skimmetine, Coumarin, 7-hydroxy-, beta-Umbelliferone, .beta.-Umbelliferone, 7-hydroxycoumarin sulfate, Spectrum2_001962, Spectrum3_000751, 2H-1-Benzopyran-2-one, 7-hydroxy-, 7 HC, 7-Hydroxy-2H-chromen-2-one, CCRIS 3591, BSPBio_002362, H24003_ALDRICH, SPECTRUM231084

Molecular Formula:	C₉H₆O₃	Molecular Weight:	162.142140 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: ORHBXUUXSCNDEV-UHFFFAOYSA-N

• Iso-Butyryl Chloride

IUPAC Name: 2-methylpropanoyl chloride | CAS Registry Number: 79-30-1
Synonyms: Isobutyryl chloride, Isobutanoyl chloride, Isobutyric acid chloride, Isobutyroyl chloride, 2-Methylpropanoyl chloride, Dimethylacetyl chloride, Chloro isopropyl ketone, 2-Methylpropionyl chloride, alpha-Methylpropionyl chloride, PROPANOYL CHLORIDE, 2-METHYL-, 139122_ALDRICH, 58420_FLUKA, EINECS 201-194-1, UN2395, ZINC01850092, LS-123213, Isobutyryl chloride [UN2395] [Flammable liquid], Isobutyryl chloride [UN2395] [Flammable liquid], InChI=1/C4H7ClO/c1-3(2)4(5)6/h3H,1-2H, 120126-85-4

Molecular Formula:	C₄H₇ClO	Molecular Weight:	106.550780 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: DGMOBVGABMBZSB-UHFFFAOYSA-N

• Isobutyl Chloroformate

IUPAC Name: 2-methylpropyl carbonochloridate | CAS Registry Number: 543-27-1
Synonyms: Isobutyl chloroformate, Isobutyl chlorocarbonate, 2-Methylpropyl chloroformate, 2-Methylpropyl carbonochloridate, Chlorocarbonic acid isobutyl ester, 177989_ALDRICH, Chloroformic acid isobutyl ester, 23191_FLUKA, NSC8429, NSC 8429, EINECS 208-840-1, NA2742, ZINC00388452, Formic acid, chloro-, isobutyl ester, CARBONOCHLORIDIC ACID, 2-METHYLPROPYL ESTER, Formic acid, chloro-, isobutyl ester (8CI), Isobutyl chloroformate [NA2742] [Poison], PB271215412, InChI=1/C5H9ClO2/c1-4(2)3-8-5(6)7/h4H,3H2,1-2H

Molecular Formula:	C₅H₉ClO₂	Molecular Weight:	136.576760 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: YOETUEMZNOLGDB-UHFFFAOYSA-N

• Isonipecotic Acid Ethyl Ester

IUPAC Name: ethyl piperidine-4-carboxylate | CAS Registry Number: 1126-09-6
Synonyms: Ethyl isonipecotate, Ethyl 4-piperidinecarboxylate, Ethyl piperidine-4-carboxylate, Oprea1_864652, E33505_ALDRICH, CID70770, NSC93792, EINECS 214-416-7, SBB004006, SDCCGMLS-0066232.P001, FS000817, TL8000364

Molecular Formula:	C₈H₁₅NO₂	Molecular Weight:	157.210200 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: RUJPPJYDHHAEEK-UHFFFAOYSA-N

• Isopropyl isocyanate

IUPAC Name: 2-isocyanatopropane | CAS Registry Number: 1795-48-8
Synonyms: 2-Isocyanatopropane, Propane, 2-isocyanato-, ISOPROPYLISOCYANATE, 141070_ALDRICH, Isocyanic acid, isopropyl ester, ALBB-003059, EINECS 217-276-5, UN2483, ZINC01850896, AI3-28282, Isopropyl isocyanate [UN2483] [Flammable liquid], InChI=1/C4H7NO/c1-4(2)5-3-6/h4H,1-2H

Molecular Formula:	C₄H₇NO	Molecular Weight:	85.104480 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: GSLTVFIVJMCNBH-UHFFFAOYSA-N

• L-Proline methyl ester hydrochloride

IUPAC Name: methyl pyrrolidine-2-carboxylate | CAS Registry Number: 2133-40-6
Synonyms: Methyl L-prolinate, Methyl DL-prolinate, Methyl 2-pyrrolidinecarboxylate, Methyl L-prolinate hydrochloride, NSC617316, AIDS130925, AIDS-130925, EINECS 218-363-0, EINECS 219-932-6, EINECS 257-714-2, NSC 617316, 2577-48-2, 52183-82-1

Molecular Formula:	C₆H₁₁NO₂	Molecular Weight:	129.157040 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: BLWYXBNNBYXPPL-UHFFFAOYSA-N

• L-Serine

IUPAC Name: (2S)-2-amino-3-hydroxypropanoic acid | CAS Registry Number: 56-45-1
Synonyms: serine, L-serine, (S)-Serine, beta-Hydroxyalanine, Polyserine, Serinum [Latin], L-ser, Serine, L-, Serina [Spanish], 3-Hydroxyalanine, Poly-L-serine, DL-Serine, L-Serin, Serine (VAN), L-(-)-Serine, L-3-Hydroxy-alanine, (-)-Serine, Serine (USP), b-Hydroxy-L-alanine, Serine [USAN:INN]

Molecular Formula:	C₃H₇NO₃	Molecular Weight:	105.092580 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	4

InChIKey: MTCFGRXMJLQNBG-REOHCLBHSA-N

• Lomefloxacin (3-Aminopyrazole)

IUPAC Name: 1H-pyrazol-5-amine | CAS Registry Number: 1820-80-0
Synonyms: 3-Aminopyrazole, 3-Pyrazolamine, 1H-Pyrazol-3-amine, Pyrazol-3-ylamine, 3-Amino-1H-pyrazole, 160644_ALDRICH, ALBB-004467, NSC76122, EINECS 217-338-1, NSC 76122, SBB004401, STK292780, ZINC04674340, FS000814, TL8001457, InChI=1/C3H5N3/c4-3-1-2-5-6-3/h1-2H,(H3,4,5,6

Molecular Formula:	C₃H₅N₃	Molecular Weight:	83.091900 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: JVVRJMXHNUAPHW-UHFFFAOYSA-N

• M-Bromobenzotrifluoride

IUPAC Name: 1-bromo-3-(trifluoromethyl)benzene | CAS Registry Number: 401-78-5
Synonyms: 3-Bromobenzotrifluoride, m-Bromobenzotrifluoride, 3-Bromobenzyltrifluoride, 3-Brombenzotrifluorid, 3-Bromotrifluoromethylbenzene, WLN: FXFFR CE, m-(Trifluoromethyl)bromobenzene, m-Bromo(trifluoromethyl)benzene, 3-(Trifluoromethyl)bromobenzene, 1-Bromo-3-(trifluoromethyl)benzene, 3-Brombenzotrifluorid [Czech], m-(Trifluoromethyl)phenyl bromide, 3-(Trifluoromethyl)phenyl bromide, Benzene, 1-bromo-3-(trifluoromethyl)-, B59004_ALDRICH, NSC 9468, 16410_FLUKA, EINECS 206-932-6, NSC9468, 1-Bromo-3-trifluoromethyl-benzene

Molecular Formula:	C₇H₄BrF₃	Molecular Weight:	225.005870 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: NNMBNYHMJRJUBC-UHFFFAOYSA-N

• m-Chlorophenol

IUPAC Name: 3-chlorophenol | CAS Registry Number: 108-43-0
Synonyms: 3-Chlorophenol, Phenol, 3-chloro-, Phenol, m-chloro-, meta-Chlorophenol, m-Chlorophenic acid, 3-Hydroxychlorobenzene, m-monochlorophenol, meta-monochlorophenol, 1li3, 3-Chloro-1-hydroxybenzene, WLN: QR CG, CCRIS 641, C62808_ALDRICH, HSDB 1413, 36747_RIEDEL, 25840_FLUKA, CHEBI:38855, EINECS 203-582-6, NSC 59700, UN2020

Molecular Formula:	C₆H₅ClO	Molecular Weight:	128.556300 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: HORNXRXVQWOLPJ-UHFFFAOYSA-N

• Malathion

IUPAC Name: diethyl 2-dimethoxyphosphinothioylsulfanylbutanedioate | CAS Registry Number: 121-75-5
Synonyms: malathion, Mercaptothion, Carbophos, Carbofos, Karbofos, Maldison, Oleophosphothion, Phosphothion, Chemathion, Ethiolacar, Fosfothion, Fosfotion, Malaspray, Carbetox, Malagran, Malakill, Malaphos, Malathon, Moscarda, Prioderm

Molecular Formula:	C₁₀H₁₉O₆PS₂	Molecular Weight:	330.358021 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	6

InChIKey: JXSJBGJIGXNWCI-UHFFFAOYSA-N

• Meldrum's Acid

IUPAC Name: 2,2-dimethyl-1,3-dioxane-4,6-dione | CAS Registry Number: 2033-24-1
Synonyms: Meldrum's acid, Isopropylidene malonate, 2,2-Dimethyl-1,3-dioxane-4,6-dione, cycl-Isopropylidene malonate, 1,3-Dioxane-4,6-dione, 2,2-dimethyl-, Cyclic isopropylidene malonate, 2,2-Dimethyl-4,6-dioxo-m-dioxane, 2,2-Dimethyl-m-dioxane-4,6-dione, 210145_ALDRICH, Malonic acid, cyclic isopropylidene ester, EINECS 217-992-8, NSC 71902, NSC688343, AIDS150666, AIDS-150666, NSC71902, BRN 0117310, ZINC01697324, m-DIOXANE-4,6-DIONE, 2,2-DIMETHYL-, AI3-39039

Molecular Formula:	C₆H₈O₄	Molecular Weight:	144.125320 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: GXHFUVWIGNLZSC-UHFFFAOYSA-N

• Methyl 2-Bromo Hexanoate (Caproate)

IUPAC Name: methyl 2-bromohexanoate | CAS Registry Number: 5445-19-2
Synonyms: Methyl 2-bromohexanoate, Methyl 2-bromocaproate, 16602_FLUKA, NSC21976, EINECS 226-643-9, 70288-61-8

Molecular Formula:	C₇H₁₃BrO₂	Molecular Weight:	209.080920 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: YGLPDRIMFIXNBI-UHFFFAOYSA-N

• Methyl 3-bromobenzoate

IUPAC Name: methyl 3-bromobenzoate | CAS Registry Number: 618-89-3
Synonyms: METHYL 3-BROMOBENZOATE, Methyl m-bromobenzoate, Benzoic acid, 3-bromo-, methyl ester, 3-Bromobenzoic acid, methyl ester, 499625_ALDRICH, 3-Bromobenzoic Acid Methyl Ester, NSC7319, Benzoic acid, m-bromo-, methyl ester, NSC 7319, EINECS 210-569-9, ZINC00403315, ST5307759, TL8003972, InChI=1/C8H7BrO2/c1-11-8(10)6-3-2-4-7(9)5-6/h2-5H,1H

Molecular Formula:	C₈H₇BrO₂	Molecular Weight:	215.043980 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: KMFJVYMFCAIRAN-UHFFFAOYSA-N

• Methyl 4-Chloro-3-Methylbenzoate

IUPAC Name: methyl 4-chloro-3-methylbenzoate | CAS Registry Number: 91367-05-4
Synonyms: Methyl 4-chloro-3-methylbenzoate, 4-Chloro-3-methylbenzoic Acid Methyl Ester, SBB064720, ZINC02517100, PubChem3710, ACMC-209r8w, SureCN2237689, CTK5G9425, MolPort-001-768-884, 2-Chloro-5-(methoxycarbonyl)toluene, ANW-39582, methyl 4-chloranyl-3-methyl-benzoate, AKOS006229001, AG-H-74844, AS00095, MCULE-2127141494, AK117510, KB-54336, 4-CHLORO-M-TOLUIC ACID METHYL ESTER, TL8007247

Molecular Formula:	C₉H₉ClO₂	Molecular Weight:	184.619560 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: QOTGNXMPQNGYDM-UHFFFAOYSA-N