King Tang Chemical Group Industry Co., Ltd.

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Profile: King Tang Chemical Industry Group Co., Ltd. provides agrochemicals, dyestuff, pharmaceuticals, and chemical intermediates. Agrochemicals include 2-ethylsulfonylimidazo[1,2-a]pyridine-3-sulfonamide, amitraz, zinc phosphide, 1-methyl-4-ethoxycarbonyl-5-pyrazolsulfonamide, 1-phenyl-3-hydroxy-1,2,4-triazole, 2,3-dichloro-5-trifluoromethyl pyridine, dalapon-sodium, decamethrin and dichlormid. Chemical intermediates include 2,4-dichloronitrobenzene, 3,4-dimethylbenzophenone, (2-chlorophenyl)diphenyl chloromethane, 1,2,3-trichlorbenzene, 1-chloroethyl chloroformate, and 1-chloro-6,6-dimethyl-2-heptene-4-yne.

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• valacyclovir

IUPAC Name: 2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethyl (2S)-2-amino-3-methylbutanoate | CAS Registry Number: 124832-26-4
Synonyms: Valaciclovir, Valtrex, Acetylpromazine, Zelitrex, Talavir, Virval, Acyclovir-valine, Valaciclovir Hcl, ValACV, ACEPROMAZINE, VACV, Valaciclovir, Valtrex, Valacyclovir hydrochloride, Valacyclover Hydrochloric, Valaciclovir hydrochloride, Valacyclover Hydrochloride, Valaciclovir [INN:BAN], valacyclovir, (L)-isomer, BSPBio_002474, MLS001304747

Molecular Formula:	C₁₃H₂₀N₆O₄	Molecular Weight:	324.335700 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	9

InChIKey: HDOVUKNUBWVHOX-QMMMGPOBSA-N

• Validamycin

IUPAC Name: (2R,3R,4S,5S,6R)-2-[(1R,2R,3S,4S,6R)-2,3-dihydroxy-6-(hydroxymethyl)-4-[[(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino]cyclohexyl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol | CAS Registry Number: 37248-47-8
Synonyms: Validacin, Valimon, VALIDAMYCIN A, CID443629, C12112

Molecular Formula:	C₂₀H₃₅NO₁₃	Molecular Weight:	497.490800 [g/mol]
H-Bond Donor:	12	H-Bond Acceptor:	14

InChIKey: JARYYMUOCXVXNK-CSLFJTBJSA-N

• Vitamin B12

IUPAC Name: cobalt(3+); [(2R,5S)-5-(5,6-dimethylbenzimidazol-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] 1-[3-[(2R,3R,4Z,7S,9Z,12S,13S,14Z,17S,18S,19R)-2,13,18-tris(2-amino-2-oxoethyl)-7,12,17-tris(3-amino-3-oxopropyl)-3,5,8,8,13,15,18,19-octamethyl-2,7,12,17-tetrahydro-1H-corrin-21-id-3-yl]propanoylamino]propan-2-yl phosphate; cyanide | CAS Registry Number: 68-19-9
Synonyms: cyanocobalamin, Erythrotin, Mecobalamin, Anacobin, Berubigen, Cytobion, Megabion, Nagravon, Rubripca, Vitarubin, Depinar, Ducobee, Hepavis, Poyamin, Sytobex, Vibalt, vitamin B12, CN-Cbl, Cyano-B12, AIDS001650

Molecular Formula:	C₆₃H₈₈CoN₁₄O₁₄P	Molecular Weight:	1355.365181 [g/mol]
H-Bond Donor:	9	H-Bond Acceptor:	22

InChIKey: FDJOLVPMNUYSCM-JLKASCPDSA-L

• Vitamin K3

IUPAC Name: 2-methylnaphthalene-1,4-dione | CAS Registry Number: 58-27-5
Synonyms: menadione, Thyloquinone, Kayquinone, Menaphthone, Kappaxin, Klottone, Panosine, Kayklot, Kolklot, Kanone, Kipca, menaquinone, Menaphthon, Prokayvit, Aquinone, Kaergona, Kappaxan, Menadion, Mitenone, Aquakay

Molecular Formula:	C₁₁H₈O₂	Molecular Weight:	172.180020 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: MJVAVZPDRWSRRC-UHFFFAOYSA-N

• Warfarin

IUPAC Name: 2-hydroxy-3-(3-oxo-1-phenylbutyl)chromen-4-one | CAS Registry Number: 81-81-2
Synonyms: warfarin, Coumafene, Prothromadin, Coumadin, Coumafen, Rattentraenke, Coumefene, Panwarfin, Rodafarin, Brumolin, Kypfarin, Rattunal, Solfarin, Warfarat, Dethmor, Dethnel, Kumader, Maveran, Ratorex, Kumadu

Molecular Formula:	C₁₉H₁₆O₄	Molecular Weight:	308.327940 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: QTXVAVXCBMYBJW-UHFFFAOYSA-N

• Ziprasidone HCl

IUPAC Name: 5-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-6-chloro-1,3-dihydroindol-2-one hydrate hydrochloride | CAS Registry Number: 138982-67-9
Synonyms: Geodon, Ziprasidone, Zeldox, Ziprasidone hydrochloride, Ziprasidone mesylate, Geodon (TN), C21H21ClN4OS.HCl, Ziprasidone hydrochloride [USAN], Ziprasidone hydrochloride monohydrate, Ziprasidone hydrochloride (USAN), ZIPRASIDONE HYDROCHLORIDE HYDRATE, ziprasidone hydrochloride, monohydrate, Ziprasidone hydrochloride hydrate (JAN), CP 88,059-1, CP-88059, LS-173039, CP-88059-01, CP 88-059-01, D01939, 2H-Indol-2-one, 5-(2-(4-(1,2-benzisothiazol-3-yl)-1-piperazinyl)ethyl)-6-chloro-1,3-dihydro-, monohydrochloride, monohydrate

Molecular Formula:	C₂₁H₂₄Cl₂N₄O₂S	Molecular Weight:	467.411860 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	5

InChIKey: ZCBZSCBNOOIHFP-UHFFFAOYSA-N

• 6-Hydroxy-5-Chloro Nicotinic Acid

• 5-Amino-1,2,3-Thiadiazole

IUPAC Name: thiadiazol-5-amine | CAS Registry Number: 4100-41-8
Synonyms: 1,2,3-Thiadiazol-5-amine, NSC267217, CID77736, EINECS 223-868-4

Molecular Formula:	C₂H₃N₃S	Molecular Weight:	101.130320 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: PVGHNTXQMCYYGF-UHFFFAOYSA-N

• 17a-Hydroxyprogesterone acetate

IUPAC Name: (17-acetyl-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl) acetate | CAS Registry Number: 302-23-8
Synonyms: Prokan, 17-Acetoxyprogesterone, 17.alpha.-Acetoxyprogesterone, 17-Hydroxyprogesterone acetate, 17-AP, NSC12191, EINECS 241-337-5, NCGC00160371-01, 17-Hydroxyprogesterone 17.alpha.-acetate, BAS 00417541, Pregn-4-ene-3,20-dione, 17-(acetyloxy)-, 17alpha-Hydroxyprogesterone-17alpha acetate, 3,20-Dioxopregn-4-en-17-beta-yl acetate, ST5228986, Pregn-4-ene-3,20-dione, 17-hydroxy-, acetate, U 5533, 17308-02-0

Molecular Formula:	C₂₃H₃₂O₄	Molecular Weight:	372.497780 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: VTHUYJIXSMGYOQ-UHFFFAOYSA-N

• 4-Methoxyphenylacetone

IUPAC Name: 1-(4-methoxyphenyl)propan-2-one | CAS Registry Number: 122-84-9
Synonyms: Anisketone, p-Acetonylanisole, p-Anisylactone, Anisic ketone, Anisalacetone, Anisolacetone, Anisyl methyl ketone, p-Methoxyphenylacetone, 4-Methoxybenzyl methyl ketone, p-Methoxybenzyl methyl ketone, 2-Propanone, 1-(4-methoxyphenyl)-, 1-(4-Methoxyphenyl)acetone, 1-(p-Anisyl)-2-propanone, 1-(p-Methoxyphenyl)-2-propanone, 4'-Methoxyphenyl-2-propanone, (p-Methoxyphenyl)-2-propanone, FEMA No. 2674, 1-(4-Methoxyphenyl)-2-propanone, ghl.PD_Mitscher_leg0.658, W267406_ALDRICH

Molecular Formula:	C₁₀H₁₂O₂	Molecular Weight:	164.201080 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: WFWKNGZODAOLEO-UHFFFAOYSA-N

• 2-Amino-4,6-dimethylpyrimidine

IUPAC Name: 4,6-dimethylpyrimidin-2-amine | CAS Registry Number: 767-15-7
Synonyms: Acetylacetoneguanidine, 4,6-Dimethyl-2-pyrimidinamine, 2-Pyrimidinamine, 4,6-dimethyl-, 2-AMINO-4,6-DIMETHYLPYRIMIDINE, 4,6-Dimethylpyrimidin-2-ylamine, Pyrimidine, 2-amino-4,6-dimethyl-, A52005_ALDRICH, ACETYLACETONE GUANIDINE, NSC 3278, 07850_FLUKA, EINECS 212-181-5, NSC3278, AIDS020788, AIDS-020788, SBB004275, ZINC00163774, AI3-08092, LS-134481, TL8005260, Pyrimidine, 2-amino-4,6-dimethyl- (8CI)

Molecular Formula:	C₆H₉N₃	Molecular Weight:	123.155760 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: IDQNBVFPZMCDDN-UHFFFAOYSA-N

• 4-Dichlorobenzene

IUPAC Name: 1,4-dichlorobenzene | CAS Registry Number: 106-46-7
Synonyms: p-Dichlorobenzene, Paranuggets, Santochlor, Paracide, Paramoth, Paradow, Evola, Persia-perazol, p-Dichlorobenzol, Globol, dichloricide, Dichlorobenzene, Paradi, 1,4-DICHLOROBENZENE, Di-chloricide, Para crystals, paradichlorobenzene, Para-zene, Dichlorocide, p-Dichlorbenzol

Molecular Formula:	C₆H₄Cl₂	Molecular Weight:	147.001960 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: OCJBOOLMMGQPQU-UHFFFAOYSA-N

• 2,4-Dichloroacetophenone

IUPAC Name: 2-chloro-1-(4-chlorophenyl)ethanone | CAS Registry Number: 937-20-2
Synonyms: 2,4'-Dichloroacetophenone, p-Chlorophenacyl chloride, 4-Chlorophenacyl chloride, 392006_ALDRICH, Acetophenone, 2,4'-dichloro-, 2-chloro-1-(4-chlorophenyl)ethanone, .alpha.-Chloro-p-chloroacetophenone, .omega.-Chloro-p-chloroacetophenone, NSC41669, EINECS 213-323-9, Halomethyl Phenyl Ketone deriv. 22, ZINC01673522, Ethanone, 2-chloro-1-(4-chlorophenyl)-, InChI=1/C8H6Cl2O/c9-5-8(11)6-1-3-7(10)4-2-6/h1-4H,5H

Molecular Formula:	C₈H₆Cl₂O	Molecular Weight:	189.038640 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: FWDFNLVLIXAOMX-UHFFFAOYSA-N

• 2,5-Dimethylphenol

IUPAC Name: 2,5-dimethylphenol | CAS Registry Number: 95-87-4
Synonyms: p-Xylenol, 2,5-Xylenol, 6-Methyl-m-cresol, Phenol, 2,5-dimethyl-, 2,5-DIMETHYLPHENOL, 3,6-Dimethylphenol, 3,6-Xylenol, 2,5-Dimethyl phenol, 1,2,5-Xylenol, 2-Hydroxy-p-xylene, 2,5-Dmp, 1-Hydroxy-2,5-dimethylbenzene, CCRIS 722, FEMA No. 3595, 1,4-Dimethyl-2-hydroxybenzene, HSDB 5296, D174602_ALDRICH, W359505_ALDRICH, WLN: QR B1 E1, 36714_RIEDEL

Molecular Formula:	C₈H₁₀O	Molecular Weight:	122.164400 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: NKTOLZVEWDHZMU-UHFFFAOYSA-N

• 2,4,5-Trifluoro-3-Methoxybenzoic Acid

IUPAC Name: 2,4,5-trifluoro-3-methoxybenzoic acid | CAS Registry Number: 112811-65-1
Synonyms: 3-methoxy-2,4,5-trifluorobenzoic acid, 2,4,5-Trifluoro-3-methoxybenzoic acid, 11281-65-5, 2,4,5-Trifluoro-m-anisic Acid, SBB063543, PubChem1352, PubChem2237, 2,4,5-trifluoro-3-methoxy-benzoic Acid, ACMC-1BT5Z, AC1MC02Q, AC1Q45KE, KSC181I7H, 524824_ALDRICH, Jsp000992, Jsp000997, CTK0I1473, MolPort-000-157-015, ACT12274, ANW-16530, 3-Methoxy-2,4,5-trifluorobenzoicacid

Molecular Formula:	C₈H₅F₃O₃	Molecular Weight:	206.118710 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	6

InChIKey: YVJHZWWMKFQKDC-UHFFFAOYSA-N

• 1,2-Propanediol

IUPAC Name: propane-1,2-diol | CAS Registry Number: 57-55-6
Synonyms: propylene glycol, 1,2-propanediol, Sirlene, propane-1,2-diol, Trimethyl glycol, Dowfrost, 2-Hydroxypropanol, Methylethyl glycol, Solargard P, 2,3-Propanediol, 1,2-Propylene glycol, Methyl glycol, Monopropylene glycol, propanediol, Methylethylene glycol, Isopropylene glycol, Solar Winter BAN, dl-Propylene glycol, 1,2-dihydroxypropane, alpha-Propyleneglycol

Molecular Formula:	C₃H₈O₂	Molecular Weight:	76.094420 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: DNIAPMSPPWPWGF-UHFFFAOYSA-N

• 2-Ethyl Phenyl Hydrazine Hydrochloride

IUPAC Name: (2-ethylphenyl)hydrazine | CAS Registry Number: 58711-02-7
Synonyms: (2-ethylphenyl)hydrazine, (2-Ethyl-phenyl)-hydrazine, Oprea1_325783, ZINC00154746, ALBB-005992, BBV-050819, CID2733210, 19398-06-2

Molecular Formula:	C₈H₁₂N₂	Molecular Weight:	136.194280 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: JHPOWXCLWLEKBY-UHFFFAOYSA-N

• 6-Chloro Nicotinic Acid

IUPAC Name: 6-chloropyridine-3-carboxylic acid | CAS Registry Number: 5326-23-8
Synonyms: 6-Chloronicotinic acid, 6-Chloro-nicotinic acid, 3-Pyridinecarboxylic acid, 6-chloro-, 6-Chloro-3-pyridinecarboxylic acid, MLS000332521, 156353_ALDRICH, NSC277, 25345_FLUKA, NSC 277, 6-Chloropyridine-3-carboxylic acid, EINECS 226-201-5, SBB004004, SMR000221815, TL8003501, InChI=1/C6H4ClNO2/c7-5-2-1-4(3-8-5)6(9)10/h1-3H,(H,9,10

Molecular Formula:	C₆H₄ClNO₂	Molecular Weight:	157.554460 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: UAWMVMPAYRWUFX-UHFFFAOYSA-N

• 2-Amino-4-Methoxy-6-Methyl-1,3,5-Triazine

IUPAC Name: 4-methoxy-6-methyl-1,3,5-triazin-2-amine | CAS Registry Number: 1668-54-8
Synonyms: Oprea1_823704, 522996_ALDRICH, EINECS 216-790-7, CV 399, ALBB-007467, s-Triazine, 2-amino-4-methoxy-6-methyl-, 2-Methyl-4-amino-6-methoxy-s-triazine, BRN 0608250, SBB004163, ZINC00193078, 4-Methoxy-6-methyl-1,3,5-triazin-2-amine, 1,3,5-Triazin-2-amine, 4-methoxy-6-methyl-, LS-155053, EU-0034780, 2-Amino-4-methoxy-6-methyl-1,3,5-triazine, 2-AMINO-4-METHOXY-6-METHYL-S-TRIAZINE, 4-methoxy-6-methyl-1,3,5-triazin-2-ylamine, 5-26-09-00404 (Beilstein Handbook Reference), AG-664/25040005

Molecular Formula:	C₅H₈N₄O	Molecular Weight:	140.143220 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	5

InChIKey: NXFQWRWXEYTOTK-UHFFFAOYSA-N

• 5-Cyanophthalide

IUPAC Name: 1-oxo-3H-2-benzofuran-5-carbonitrile | CAS Registry Number: 82104-74-3
Synonyms: 5-Cyano-3H-isobenzofuranone, 647195_ALDRICH, ZINC00337934, EINECS 279-900-2, CID821218, TL8005440, 1,3-Dihydro-1-oxo-5-isobenzofurancarbonitrile, 1,3-Dihydro-1-oxoisobenzofuran-5-carbonitrile, 1-oxo-1,3-dihydro-2-benzofuran-5-carbonitrile, AR-011/40257489

Molecular Formula:	C₉H₅NO₂	Molecular Weight:	159.141500 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: XEEGWTLAFIZLSF-UHFFFAOYSA-N

• 2-(1-Naphthyl) Acetamide

IUPAC Name: 2-naphthalen-1-ylacetamide | CAS Registry Number: 86-86-2
Synonyms: Rootone, Frufix, Amid-Thin, Dirigol N, 1-Naphthylacetamide, Amid-Thin W, NAAm, Fruitone, Rosetone, Naamide, alpha-NAA amide, Naphthaleneacetamide, 1-NAPHTHALENEACETAMIDE, alpha-Naphthylacetamide, Caswell No. 588, Naphthalene acetamide, 1-Naphthalene acetamide, 2-(1-Naphthyl)acetamide, 1-Naphthyl-acetamide, alpha-Naphthaleneacetamide

Molecular Formula:	C₁₂H₁₁NO	Molecular Weight:	185.221840 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: XFNJVKMNNVCYEK-UHFFFAOYSA-N

• 2-{{{ [(4-Methoxy-6-Methyl-1,3,5-Triazin-2-Yl)-Amino]-Carbonyl}-Amino}-Sulphonyl}-Benzoic Acidmethyl Ester

IUPAC Name: methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate | CAS Registry Number: 74223-64-6
Synonyms: Metsulfuron methyl, Granstar, Gropper, Escort, Allie, Brush-off, ALLY, Metsulfuron-Me, METSULFURON-METHYL, Escort (pesticide), Metsulphuron methyl, Caswell No. 419H, TRIBENURON-METHYL, ALLY 20DF, HCHA 92HA, PS1078_SUPELCO, Oprea1_737469, CBDivE_002527, HSDB 6849, Metsulfuron methyl ester [ANSI]

Molecular Formula:	C₁₄H₁₅N₅O₆S	Molecular Weight:	381.363800 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	9

InChIKey: RSMUVYRMZCOLBH-UHFFFAOYSA-N

• 2,3,5,6-Tetrachloroterephthalic acid dimethyl ester

IUPAC Name: dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate | CAS Registry Number: 1861-32-1
Synonyms: dacthal, Chlorthal-dimethyl, Dacthalor, Fatal, Chlorthal-methyl, Tetral, DCPA, Chlorothal, Chlorthal, Dactal, Daktal [Czech], TCTP, Caswell No. 382, Chlorthal dimethyl ester, DAC 4, DCPA (VAN), Spectrum_001803, SpecPlus_000394, PS33_SUPELCO, Spectrum2_001876

Molecular Formula:	C₁₀H₆Cl₄O₄	Molecular Weight:	331.964240 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: NPOJQCVWMSKXDN-UHFFFAOYSA-N

• 2,6-Dichlorobenzonitrile

IUPAC Name: 2,6-dichlorobenzonitrile | CAS Registry Number: 1194-65-6
Synonyms: dichlobenil, Dichlobanil, Casoron, Cyclomec, Decabane, Dyclomec, Surfassol, Norosac, Casoron gsr, DU-Sprex, Carsoron, Casaron, Prefix D, DBN (pesticide), Casoron 133, Casoron G-4, DBN (the herbicide), Casoron G-10, Casoron G20 SR, Casoron W-50

Molecular Formula:	C₇H₃Cl₂N	Molecular Weight:	172.011420 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: YOYAIZYFCNQIRF-UHFFFAOYSA-N

• 2,2,2-Trifluoroethanol

IUPAC Name: 2,2,2-trifluoroethanol | CAS Registry Number: 75-89-8
Synonyms: Trifluoroethanol, Fluorinol 85, Ethanol, 2,2,2-trifluoro-, 2,2,2-TRIFLUOROETHANOL, Trifluoroethyl alcohol, 2,2,2-Trifluoroethyl alcohol, Alcohol, Trifluoroethyl, CF3CH2OH, WLN: Q1XFFF, Perfluoro-1,1-dihydroethanol, T63002_ALDRICH, NSC 451, beta,beta,beta-Trifluoroethyl alcohol, NSC451, 91683_FLUKA, 96924_FLUKA, CHEBI:42330, EINECS 200-913-6, ETHANOL,2,2,2-TRIFLUORO, 326747_SIAL

Molecular Formula:	C₂H₃F₃O	Molecular Weight:	100.039830 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: RHQDFWAXVIIEBN-UHFFFAOYSA-N

• 4-Fluoro-4'-methoxybenzophenone

IUPAC Name: (4-fluorophenyl)-(4-methoxyphenyl)methanone | CAS Registry Number: 345-89-1
Synonyms: 4-methoxy-4'-fluorobenzophenone, ZINC00129402, CID67664, EINECS 206-464-2, XBX 00254, TL8002576, SR-01000633195-1

Molecular Formula:	C₁₄H₁₁FO₂	Molecular Weight:	230.234343 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: VWGWRNBIAWTWIB-UHFFFAOYSA-N

• 4-Fluorobenzophenone

IUPAC Name: (4-fluorophenyl)-phenylmethanone | CAS Registry Number: 345-83-5
Synonyms: p-Fluorobenzophenone, Maybridge4_003548, F7202_ALDRICH, NCIOpen2_001224, (4-Fluorophenyl)(phenyl)methanone, NSC88321, EINECS 206-463-7, NSC 88321, ZINC00105242, SB 01595, InChI=1/C13H9FO/c14-12-8-6-11(7-9-12)13(15)10-4-2-1-3-5-10/h1-9

Molecular Formula:	C₁₃H₉FO	Molecular Weight:	200.208363 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: OGTSHGYHILFRHD-UHFFFAOYSA-N

• 7-Ethyl-3-(2-Hydroxyethyl) Indole

IUPAC Name: 2-(7-ethyl-1H-indol-3-yl)ethanol | CAS Registry Number: 41340-36-7
Synonyms: 7-Ethyltryptophol, Ambap6397, 7-Ethyl-1H-indole-3-ethanol, CCRIS 5406, 7-Ethyl-3-(2-hydroxyethyl)indole, RAK-801, 1H-Indole-3-ethanol, 7-ethyl-, BRN 1074382, LS-83066, TL8000417, E-9050

Molecular Formula:	C₁₂H₁₅NO	Molecular Weight:	189.253600 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: UVSDNCAZVSQJQA-UHFFFAOYSA-N

• 5-MethylUridine (Ribothymidine)

IUPAC Name: 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione | CAS Registry Number: 1463-10-1
Synonyms: Ribothymidine, 5-Methyluridine, Thymine riboside, Ambap220, Uridine, 5-methyl-, nchembio.2007.30-comp3d, 5MU-5MU-5MU, M8905_SIGMA, 535893_ALDRICH, CHEBI:30821, AIDS184529, AIDS-184529, EINECS 215-973-9, ZINC02583634, 5-METHYLURIDINE 5'-MONOPHOSPHATE, TL8001022, 1-((2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-5-methylpyrimidine-2,4(1H,3H)-dione, 1-[(4S,2R,3R,5R)-3,4-Dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-1,3-dihydropyrimidine-2,4-dione, 5MU, 849658-09-9

Molecular Formula:	C₁₀H₁₄N₂O₆	Molecular Weight:	258.227960 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	6

InChIKey: DWRXFEITVBNRMK-JXOAFFINSA-N

• 2-Methyl Chloro-Propionate

IUPAC Name: methyl (2R)-2-chloropropanoate | CAS Registry Number: 17639-93-9
Synonyms: Methyl 2-chloropropanoate, CCRIS 7388, Methyl (R)-2-chloropropionate, 277754_ALDRICH, EINECS 278-658-5, (R)-2-Chloropropanoic acid methyl ester, ZINC02017921, (R)-()-Methyl (R)-2-chloropropionate, Propanoic acid, 2-chloro-, methyl ester, LS-188775, (R)-()-2-Chloropropionic acid methyl ester, InChI=1/C4H7ClO2/c1-3(5)4(6)7-2/h3H,1-2H, 77287-29-7

Molecular Formula:	C₄H₇ClO₂	Molecular Weight:	122.550180 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: JLEJCNOTNLZCHQ-GSVOUGTGSA-N

• 2-Amino-4-Chloro-6-Methoxy Pyrimidine

IUPAC Name: 4-chloro-6-methoxypyrimidin-2-amine | CAS Registry Number: 5734-64-5
Synonyms: 518646_ALDRICH, 2-Amino-4-chloro-6-methoxypyrimidine, Pyrimidine, 2-amino-4-chloro-6-methoxy-, 4-chloro-6-methoxypyrimidin-2-amine, ALBB-006235, NSC28420, 2-Pyrimidinamine, 4-chloro-6-methoxy-, SBB003975, ZINC00333476, 4-Chloro-6-methoxy-pyrimidin-2-ylamine, LS-134445, TL8003695, AG-670/25003515, InChI=1/C5H6ClN3O/c1-10-4-2-3(6)8-5(7)9-4/h2H,1H3,(H2,7,8,9

Molecular Formula:	C₅H₆ClN₃O	Molecular Weight:	159.573640 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: VFEYBTFCBZMBAU-UHFFFAOYSA-N

• 2-Benzyl Chloride Fluoride

IUPAC Name: 1-(chloromethyl)-3-fluorobenzene | CAS Registry Number: 456-42-8
Synonyms: 3-Fluorobenzyl chloride, 3-Fluorobenzylchloride, M-FLUOROBENZYL CHLORIDE, alpha-Chloro-3-fluorotoluene, alpha-Chloro-m-fluorotoluene, F7806_ALDRICH, Benzene, 1-(chloromethyl)-3-fluoro-, Toluene, .alpha.-chloro-m-fluoro-, .alpha.-Chloro-m-fluorotoluene, 1-(Chloromethyl)-3-fluorobenzene, 1-Chloromethyl-3-fluorobenzene, .alpha.-Chloro-3-fluorotoluene, 46821_FLUKA, CID9974, NSC60720, EINECS 207-264-8, NSC 60720, ZINC00164512, Toluene, alpha-chloro-m-fluoro- (8CI), F118

Molecular Formula:	C₇H₆ClF	Molecular Weight:	144.573943 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: XBDXMDVEZLOGMC-UHFFFAOYSA-N

• 6-Fluoro-3-(4-piperidinyl)-1,2-benzisoxazole

IUPAC Name: 6-fluoro-3-piperidin-4-yl-1,2-benzoxazole;hydrochloride | CAS Registry Number: 84163-13-3
Synonyms: 6-Fluoro-3-(4-piperidinyl)-1,2-benzisoxazole hydrochloride, 6-Fluoro-3-piperid-4-yl-1,2-benzisoxazole HCl, 6-Fluoro-3-(4-piperidinyl)-1,2-benzisoxazole HCl, 6-Fluoro-3-(4-piperidyl)-1,2-benzisoxazole hydrochloride, 4-(6-Fluoro-1,2-benzisoxazol-3-yl)piperidine hydrochloride, 6-Fluoro-3-(4-piperidinyl)-1,2-benzisoxazolehydrochloride, 6-fluoro-3-(piperidin-4-yl)-1,2-benzoxazole hydrochloride, 6-fluoro-3-(piperidin-4-yl)benzo[d]isoxazole hydrochloride, 6-Fluoro-3-piperidin-4-yl-1,2-benzisoxazole hydrochloride, R-56109 hydrochloride, SureCN531052, UNII-X3U18DS1Y7, AGN-PC-0070EP, CTK3J8204, MolPort-000-847-414, BB_SC-4607, ACN-S003860, ACT02050, ANW-50685, RW2416

Molecular Formula:	C₁₂H₁₄ClFN₂O	Molecular Weight:	256.703763 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: CWPSRUREOSBKBQ-UHFFFAOYSA-N

• (R)-3-Hydroxy-1-benzylpyrrolidine

IUPAC Name: (3R)-1-benzylpyrrolidin-3-ol | CAS Registry Number: 101930-07-8
Synonyms: (R)-(+)-1-Benzyl-3-pyrrolidinol, (R)-1-Benzyl-3-hydroxypyrrolidine, (r)-1-n-benzyl-3-hydroxypyrrolidine, (R)-1-Benzyl-3-pyrrolidinol, (3R)-1-benzylpyrrolidin-3-ol, r-bhp, (r)-n-benzyl-3-hydroxypyrrolidine, (r)-3-hydroxy-1-benzylpyrrolidine, (r)-n-benzyl-3-pyrrolidinol, (R)-1-Benzylpyrrolidin-3-ol, r-3-n-benzyl-hydroxypyrrolidine, (3r)-(+)-n-benzyl-3-pyrrolidinol, (R)-3-Hydroxy-1-benzyl-pyrrolidine, (r)-(+)-n-benzyl 3-hydroxypyrrolidine, 3-Pyrrolidinol, 1-(phenylmethyl)-, PubChem13096, AC1LD7AY, SureCN741364, 366935_ALDRICH, AC1Q59J3

Molecular Formula:	C₁₁H₁₅NO	Molecular Weight:	177.242900 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: YQMXOIAIYXXXEE-LLVKDONJSA-N

• 1H-Benzimidazol-2-Ylcarbamic Acid Methyl Ester

IUPAC Name: methyl N-(1H-benzimidazol-2-yl)carbamate | CAS Registry Number: 10605-21-7
Synonyms: Carbendazim, Carbendazole, Mecarzole, Carbendazime, Carbendazol, Bavistin, Thicoper, Derosal, Funaben, Carbendazym, Equitdazin, Falicarben, Pillarstin, Supercarb, Bavistan, Fungisol, Garbenda, Kemdazin, Medamine, Triticol

Molecular Formula:	C₉H₉N₃O₂	Molecular Weight:	191.186660 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: TWFZGCMQGLPBSX-UHFFFAOYSA-N

• 3-Piperazinobenzisothiazole

IUPAC Name: 3-piperazin-1-yl-1,2-benzothiazole;hydrochloride | CAS Registry Number: 144010-02-6
Synonyms: 3-Piperazinobenzisothiazole hydrochloride, 87691-88-1, 3-Piperazinyl-1,2-Benzisothiazole Hydrochloride, CHEMBL1204336, 1,2-Benzisothiazole,3-(1-piperazinyl),hydrochloride, 3-(Piperazin-1-yl)benzo[d]isothiazole hydrochloride, 3-Piperazin-1-yl-benzo[d]isothiazole hydrochloride, 3-(1-piperazinyl)-1,2-Benzisothiazole hydrochloride, AGN-PC-00ASXZ, SureCN1737330, UNII-OSY1987N5V, MLS000718830, Ziprasidone related compound A, Jsp002576, CTK7D1714, MolPort-000-002-436, ACN-S003747, ACT02169, ANW-51377, AKOS015849232

Molecular Formula:	C₁₁H₁₄ClN₃S	Molecular Weight:	255.766960 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: DOQLJTKEUIJSKK-UHFFFAOYSA-N

• 2-Butyl-3-(4-Hydroxybenzoyl) Benzofuran

IUPAC Name: (2-butyl-1-benzofuran-3-yl)-(4-hydroxyphenyl)methanone | CAS Registry Number: 52490-15-0
Synonyms: ChemDiv3_001455, NCIOpen2_004928, Oprea1_408298, Oprea1_854919, ZINC01760380, CID96670, NSC85438, EINECS 257-959-5, 2-Butyl-3-(4-hydroxybenzoyl)benzofuran, IDI1_020421, 2-Butyl-3-(4'-hydroxybenzoyl)benzofuran, BAS 00532176, UNM000011033701, C15049, L 3372, (2-Butylbenzofuran-3-yl)(4-hydroxyphenyl)ketone, (2-Butylbenzofuran-3-yl) (4-hydroxyphenyl) ketone, (2-Butyl-benzofuran-3-yl)-(4-hydroxy-phenyl)-methanone, Methanone, (2-butyl-3-benzofuranyl)(4-hydroxyphenyl)-

Molecular Formula:	C₁₉H₁₈O₃	Molecular Weight:	294.344420 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: ZHGKQUXXASLVQQ-UHFFFAOYSA-N

• 3-Hydroxybenzaldehyde

IUPAC Name: 3-hydroxybenzaldehyde | CAS Registry Number: 100-83-4
Synonyms: m-Formylphenol, 3-hydroxybenzaldehyde, 3-Formylphenol, m-Hydroxybenzaldehyde, Benzaldehyde, 3-hydroxy-, meta-Hydroxybenzaldehyde, Benzaldehyde, m-hydroxy-, 3-OH-BENZALDEHYDE, H19808_ALDRICH, 3-HYDROXY-BENZALDEHYDE, NSC 3504, CHEBI:16207, EINECS 202-892-9, NSC3504, BRN 0507099, c0055, ZINC00901630, AI3-12120, LS-25059, ST5213351

Molecular Formula:	C₇H₆O₂	Molecular Weight:	122.121340 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: IAVREABSGIHHMO-UHFFFAOYSA-N

• 2-Ethylphenylhydrazine hydrochloride

IUPAC Name: (2-ethylphenyl)hydrazine | CAS Registry Number: 19398-06-2
Synonyms: (2-ethylphenyl)hydrazine, (2-Ethyl-phenyl)-hydrazine, Oprea1_325783, ZINC00154746, ALBB-005992, BBV-050819, CID2733210, 58711-02-7

Molecular Formula:	C₈H₁₂N₂	Molecular Weight:	136.194280 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: JHPOWXCLWLEKBY-UHFFFAOYSA-N

• 2-Hydroxy-2-Mercaptopyrimidine

IUPAC Name: 2-sulfanylidene-1H-pyrimidin-4-one | CAS Registry Number: 141-90-2
Synonyms: 2-thiouracil, Antagothyroid, Thiouracil, Antagothyroil, Deracil, Nobilen, 6-Thiouracil, Uracil, 2-thio-, Tiouracyl [Polish], 2-Mercapto-4-pyrimidone, 2-Thiouracil (VAN), 2-Mercapto-4-pyrimidinol, 2-Thio-4-oxypyrimidine, 2-Thio-6-oxypyrimidine, 4-Hydroxy-2-pyrimidinethiol, 4-Hydroxy-2-mercaptopyrimidine, Ambap4491, Spectrum_001652, 4-Pyrimidinol, 2-mercapto-, SpecPlus_000746

Molecular Formula:	C₄H₄N₂OS	Molecular Weight:	128.152360 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	1

InChIKey: ZEMGGZBWXRYJHK-UHFFFAOYSA-N

• 2-Chloro-2',6'-diethyl-N-(butoxymethyl)acetanilide

IUPAC Name: N-(butoxymethyl)-2-chloro-N-(2,6-diethylphenyl)acetamide | CAS Registry Number: 23184-66-9
Synonyms: BUTACHLOR, Machete, Machette, Rasayanchlor, Hiltachlor, Pillarsete, Amichlor, Bilchlor, Butaclor, Delchlor, Butanex, Weedout, Mach-Mach, Delchlor 5G, Machete (herbicide), Dow Formula 40, Gormel's Weed Kil, Caswell No. 119B, Home Use Weed Killer, Butachlor [ANSI:BSI:ISO]

Molecular Formula:	C₁₇H₂₆ClNO₂	Molecular Weight:	311.846840 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: HKPHPIREJKHECO-UHFFFAOYSA-N

• 6-Benzylaminopurine

IUPAC Name: N-(phenylmethyl)-7H-purin-6-amine | CAS Registry Number: 1214-39-7
Synonyms: N-Benzyladenine, Benzyladenine, N6-Benzyladenine, 6-Benzyladenine, Benzylaminopurine, Cytokinin B, Adenine, N-benzyl-, 6-(Benzylamino)purine, Pro-Shear, 6-Benzyl adenine, BAP (cytokinin), BA (Growth stimulant), N(6)-Benzylaminopurine, BAP (growth stimulant), Prestwick_414, Aminopurine, 6-benzyl, Caswell No. 081EE, Verdan senescence inhibitor, N(sup 6)-Benzyladenine, Benzyl(purin-6-yl)amine

Molecular Formula:	C₁₂H₁₁N₅	Molecular Weight:	225.249240 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	5

InChIKey: NWBJYWHLCVSVIJ-UHFFFAOYSA-N

• 2-Fluoro Benzophenone

IUPAC Name: (2-fluorophenyl)-phenylmethanone | CAS Registry Number: 342-24-5
Synonyms: 2-Fluorobenzophenone, o-Fluorobenzophenone, NCIOpen2_001483, NSC88283, EINECS 206-440-1, ZINC01847555, ST5319360, TL8002548

Molecular Formula:	C₁₃H₉FO	Molecular Weight:	200.208363 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: DWFDQVMFSLLMPE-UHFFFAOYSA-N

• (2,3,5,6-tetrafluoro-4-methylphenyl)methanol

IUPAC Name: (2,3,5,6-tetrafluoro-4-methylphenyl)methanol | CAS Registry Number: 79538-03-7
Synonyms: ZINC02506527, CID2734209, T192, 2,3,5,6-Tetrafluoro-4-methylbenzyl alcohol

Molecular Formula:	C₈H₆F₄O	Molecular Weight:	194.126253 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	5

InChIKey: PJCSTULKVNHEGW-UHFFFAOYSA-N

• 10-Methoxyiminostilbene

IUPAC Name: 6-methoxy-11H-benzo[b][1]benzazepine | CAS Registry Number: 4698-11-7
Synonyms: Ambap3637, 10-methyoxy iminostilbene, EINECS 225-172-6, 10-Methoxy-5H-dibenz(b,f)azepine, CID78424, TL8000013

Molecular Formula:	C₁₅H₁₃NO	Molecular Weight:	223.269820 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: ZKHZWXLOSIGIGZ-UHFFFAOYSA-N

• 3-Indole Acetic Acid

IUPAC Name: 2-(1H-indol-3-yl)acetic acid | CAS Registry Number: 87-51-4
Synonyms: indoleacetic acid, Heteroauxin, Rhizopin, 3-Indoleacetic acid, auxin, indole-3-acetic acid, indoleacetate, Hexteroauxin, Rhizopon A, 1H-Indole-3-acetic acid, indole-3-acetate, Acetic acid, indolyl-, 3-Iaa, beta-Indoleacetic acid, 3-(Carboxymethyl)indole, Heteroauxinhexteroauxiniaa, alpha-IAA, beta-Indolylacetic acid, Indol-3-ylacetic acid, beta-IAA

Molecular Formula:	C₁₀H₉NO₂	Molecular Weight:	175.183960 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: SEOVTRFCIGRIMH-UHFFFAOYSA-N

• 4-Benzoylbiphenyl

IUPAC Name: phenyl-(4-phenylphenyl)methanone | CAS Registry Number: 2128-93-0
Synonyms: 4-Phenylbenzophenone, p-Benzoylbiphenyl, p-Phenylbenzophenone, Benzophenone, 4-phenyl-, Trigonal 12, Eusolex 3490, 4-Diphenyl phenyl ketone, 4-Diphenylphenyl ketone, p-Biphenylyl phenyl ketone, Phenyl p-biphenylyl ketone, 4-Biphenylyl phenyl ketone, Maybridge4_000539, NCIOpen2_001988, B12601_ALDRICH, EINECS 218-345-2, NSC 55283, NSC 97365, Methanone, [1,1'-biphenyl]-4-ylphenyl-, NSC55283, NSC97365

Molecular Formula:	C₁₉H₁₄O	Molecular Weight:	258.313860 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: LYXOWKPVTCPORE-UHFFFAOYSA-N

• 2-Mercaptan Benzamidazole

IUPAC Name: 1,3-dihydrobenzimidazole-2-thione | CAS Registry Number: 583-39-1
Synonyms: Antiegene MB, 2-Mercaptobenzimidazole, 2-Benzimidazolethiol, Antioxidant MB, Antigene MB, Antigen MB, o-Phenylenethiourea, Benzimidazolethiol, Permanax 21, 2-Thiobenzimidazole, Mercaptobenzimidazole, Mercaptobenzoimidazole, Anitiegene MB, AOMB, 2-Thiol benzimidazole, 2-Benzimidazolinethione, ASM MB, Merkaptobenzimidazol, 1H-Benzimidazole-2-thiol, Benzimidazole-2-thiol

Molecular Formula:	C₇H₆N₂S	Molecular Weight:	150.200940 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	0

InChIKey: YHMYGUUIMTVXNW-UHFFFAOYSA-N

• 4-Chloro-4'-Hydroxybenzophenone (CAS: 42019-78-2)

• 2-Chloroacetophenone

IUPAC Name: 2-chloro-1-phenylethanone | CAS Registry Number: 532-27-4
Synonyms: Phenacyl chloride, Tear Gas, Phenacylchloride, Mace, Chemical mace, Nutmeg butter, Nutmeg fat, Nutmeg oleoresin, Macis oil, Mace (lacrimator), Oil of nutmeg, Oil of mace, Oils, mace, Nutmeg butter fat, CN (lacrimator), 1-Chloroacetophenone, Nutmeg oil, fixed, Acetophenone, 2-chloro-, CHLOROACETOPHENONE, Fats, nutmeg butter

Molecular Formula:	C₈H₇ClO	Molecular Weight:	154.593580 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: IMACFCSSMIZSPP-UHFFFAOYSA-N