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Esprix Technologies

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• trans-1,4-dibromobut-2-ene
IUPAC Name: (E)-1,4-dibromobut-2-ene | CAS Registry Number: 821-06-7
Synonyms: Dibromobutene, 1,4-Dibromo-2-butene, sGPDAbWDRUZZBJ@, (E)-1,4-Dibromo-2-butene, 1,4-Dibromobut-2-ene, trans-1,4-Dibromobut-2-ene, 2-BUTENE, 1,4-DIBROMO-, (E)-1,4-Dibromobut-2-ene, (2E)-1,4-dibromobut-2-ene, D39207_ALDRICH, trans-1,4-Dibromo-2-Butene, TL 80, 2-Butene, 1,4-dibromo-, (2E)-, (2E)-1,4-Dibromo-2-butene, EINECS 212-472-7, EINECS 230-219-9, 2-Butene, 1,4-dibromo-, (E)-, NSC 23187, BRN 1719694, BRN 1719696

Molecular Formula: C4H6Br2Molecular Weight: 213.898440 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: RMXLHIUHKIVPAB-OWOJBTEDSA-N

• Tri Chloro Acetate
IUPAC Name: 2,2,2-trichloroacetic acid | CAS Registry Number: 76-03-9
Synonyms: TRICHLOROACETIC ACID, Trichloroacetate, Aceto-caustin, Konesta, Trichloracetic acid, Tecane, Acetic acid, trichloro-, Trichloroethanoic acid, Amchem grass killer, Trichloressigsaeure, Trichloorazijnzuur, Caswell No. 870, Acido tricloroacetico, sNplJqDJHtQdTaeTp@, Acide trichloracetique, TCA [BSI:ISO], Trichloorazijnzuur [Dutch], WLN: QVXGGG, PS34_SUPELCO, Trichloressigsaeure [German]

Molecular Formula: C2HCl3O2Molecular Weight: 163.387140 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YNJBWRMUSHSURL-UHFFFAOYSA-N

• Tribromo Methyl Phenyl Sulphone
IUPAC Name: tribromomethylsulfonylbenzene | CAS Registry Number: 17025-47-7
Synonyms: Ambap5015, Tribromomethyl phenyl sulfone, ((Tribromomethyl)sulphonyl)benzene, EINECS 241-096-6, ZINC02169669, Benzene, ((tribromomethyl)sulfonyl)-, Benzene, [(tribromomethyl)sulfonyl]-, TL8006868

Molecular Formula: C7H5Br3O2SMolecular Weight: 392.890400 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: DWWMSEANWMWMCB-UHFFFAOYSA-N

• Triethylamine Hydrochloride
IUPAC Name: N,N-diethylethanamine hydrochloride | CAS Registry Number: 554-68-7
Synonyms: Triethylammonium chloride, Triethylamine, hydrochloride, TRIETHYLAMINE HCl, Triethylamine monohydrochloride, TRIETHYLAMINE HYDROCHLORIDE, Amine, triethyl, hydrochloride, HSDB 5689, 90350_FLUKA, 96249_FLUKA, EINECS 209-067-2, Ethanamine, N,N-diethyl-, hydrochloride, NSC 30600, NSC30600, AI3-19386, Ethanamine,n,n-diethyl-, hydrochloride, LS-157345, 121-44-8

Molecular Formula: C6H16ClNMolecular Weight: 137.650940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: ILWRPSCZWQJDMK-UHFFFAOYSA-N

• Trifluoroanisole
IUPAC Name: trifluoromethoxybenzene | CAS Registry Number: 456-55-3
Synonyms: (Trifluoromethoxy)benzene, Phenyl trifluoromethyl ether, trifluoromethyloxy-benzene, Benzene, (trifluoromethoxy)-, 337064_ALDRICH, alpha,alpha,alpha-Trifluoroanisole, EINECS 207-269-5, ZINC00167127, ST5405138

Molecular Formula: C7H5F3OMolecular Weight: 162.109210 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: GQHWSLKNULCZGI-UHFFFAOYSA-N

• Trimethyl Ammonium Chloride
IUPAC Name: N,N-dimethylmethanamine hydrochloride | CAS Registry Number: 593-81-7
Synonyms: Trimethylamine hydrochloride, Trimethylamine, hydrochloride, T72761_ALDRICH, TRIMETHYLAMMONIUM CHLORIDE, Trimethylamine monohydrochloride, 64961_FLUKA, 92270_FLUKA, WLN: 1N1&1 &GH, NSC91484, Trimethylamine hydrochloride solution, N,N-dimethylmethanamine hydrochloride, Methanamine, N,N-dimethyl-, hydrochloride, Trimethylamine hydrochloride 0.1 M solution, Additive Screening Solution 41/Fluka kit no 78374

Molecular Formula: C3H10ClNMolecular Weight: 95.571200 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: SZYJELPVAFJOGJ-UHFFFAOYSA-N

• 2,3-Dimethylphenylboronic Acid
IUPAC Name: (2,3-dimethylphenyl)boronic acid | CAS Registry Number: 183158-34-1
Synonyms: 2,3-Dimethylphenylboronic acid, 483508_ALDRICH, BM435, TL8001471

Molecular Formula: C8H11BO2Molecular Weight: 149.982740 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: ZYYANAWVBDFAHY-UHFFFAOYSA-N

• 2-chloro-4-bromobenzoic acid
IUPAC Name: 4-bromo-2-chlorobenzoic acid | CAS Registry Number: 59748-90-2
Synonyms: 4-Bromo-2-chlorobenzoic acid, 2-Chloro-4-bromobenzoic acid, 664014_ALDRICH, Benzoic acid, 4-bromo-2-chloro-, EINECS 261-911-9, ST5408664, TL8003799

Molecular Formula: C7H4BrClO2Molecular Weight: 235.462460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: JAVZWSOFJKYSDY-UHFFFAOYSA-N

• 4-Fluoro-2-iodotoluene
IUPAC Name: 4-fluoro-2-iodo-1-methylbenzene | CAS Registry Number: 13194-67-7
Synonyms: 643068_ALDRICH, EINECS 236-153-7, CID83220, TL8000758

Molecular Formula: C7H6FIMolecular Weight: 236.025413 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: RZGYAMQMAVTAKP-UHFFFAOYSA-N

• 5-Bromosalicylic Acid
IUPAC Name: 5-bromo-2-hydroxybenzoic acid | CAS Registry Number: 89-55-4
Synonyms: 5-Bromosalicylic acid, 5-Bromo-2-hydroxybenzoic acid, SALICYLIC ACID, 5-BROMO-, Benzoic acid, 5-bromo-2-hydroxy-, 2-Hydroxy-5-bromobenzoic acid, Oprea1_842232, Benzoic acid, 3-bromo-6-hydroxy-, 461814_ALDRICH, NSC 3981, EINECS 201-917-0, NSC3981, AIDS018047, AIDS-018047, NSC52393, BRN 2209121, AI3-22146, LS-144259, ST5308526, 4-10-00-00217 (Beilstein Handbook Reference), AB-016/30008027

Molecular Formula: C7H5BrO3Molecular Weight: 217.016800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: IEJOONSLOGAXNO-UHFFFAOYSA-N

• 2-Chlorophenylacetic Acid
IUPAC Name: 2-(2-chlorophenyl)acetic acid | CAS Registry Number: 2444-36-2
Synonyms: o-Chlorophenylacetic acid, 2-CHLOROPHENYLACETIC ACID, (o-Chlorophenyl)acetic acid, (2-Chlorophenyl)acetic acid, Benzeneacetic acid, 2-chloro-, Acetic acid, (o-chlorophenyl)-, 190632_ALDRICH, 25929_FLUKA, NSC4613, NSC 4613, EINECS 219-482-0, Benzeneacetic acid, 2-chloro- (9CI), Acetic acid, (o-chlorophenyl)- (8CI), TL806387, AI3-20877, ST5406670, InChI=1/C8H7ClO2/c9-7-4-2-1-3-6(7)5-8(10)11/h1-4H,5H2,(H,10,11

Molecular Formula: C8H7ClO2Molecular Weight: 170.592980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: IUJAAIZKRJJZGQ-UHFFFAOYSA-N

• 3,5-Dichloroacetophenone
IUPAC Name: 1-(3,5-dichlorophenyl)ethanone | CAS Registry Number: 14401-72-0
Synonyms: 3',5'-Dichloroacetophenone, 1-(3,5-dichlorophenyl)ethanone, 1-acetyl-3,5-dichlorobenzene, 1-(3,5-dichlorophenyl)ethan-1-one, Ethanone, 1-(3,5-dichlorophenyl)-, SBB055399, ZINC04254315, PubChem3389, AC1MBXAH, SureCN111207, CTK4C3898, MolPort-000-153-934, ACT00188, Ethanone,1-(3,5-dichlorophenyl)-, ANW-53798, AKOS006345269, 1-[3,5-bis(chloranyl)phenyl]ethanone, AB02007, AG-A-46527, AG-D-86899

Molecular Formula: C8H6Cl2OMolecular Weight: 189.038640 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: JGMBBKVZFUHCJC-UHFFFAOYSA-N

• 3-Fluoroanisole
IUPAC Name: 1-fluoro-3-methoxybenzene | CAS Registry Number: 456-49-5
Synonyms: m-Fluoroanisole, 1-FLUORO-3-METHOXYBENZENE, Benzene, 1-fluoro-3-methoxy-, NCIOpen2_001323, 162310_ALDRICH, NSC88277, EINECS 207-267-4, ZINC00388393, F105, TL8003177, InChI=1/C7H7FO/c1-9-7-4-2-3-6(8)5-7/h2-5H,1H

Molecular Formula: C7H7FOMolecular Weight: 126.128283 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: MFJNOXOAIFNSBX-UHFFFAOYSA-N

• 3,5-Dibromobenzaldehyde
IUPAC Name: 3,5-dibromobenzaldehyde | CAS Registry Number: 56990-02-4
Synonyms: SBB062920, AG-G-00722, ZINC02530981, PubChem3069, ACMC-209lvd, AC1LDNA7, 3,5-Dibromo-benzaldehyde, KSC493O2P, 3,5-bis(bromanyl)benzaldehyde, 515396_ALDRICH, PARAGOS 530307, CTK3J3727, MolPort-001-768-387, ACT01137, ANW-32615, TD1151, WT1598, AKOS005215820, AB04160, AS03025

Molecular Formula: C7H4Br2OMolecular Weight: 263.914060 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: ZLDMZIXUGCGKMB-UHFFFAOYSA-N

• 2-Bromo-5-fluorobenzonitrile
IUPAC Name: 2-bromo-5-fluorobenzonitrile | CAS Registry Number: 57381-39-2
Synonyms: 532754_ALDRICH, ZINC00403508, CID93654, EINECS 260-711-9, ST5408659, TL80074146

Molecular Formula: C7H3BrFNMolecular Weight: 200.007823 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: MDHNVHCZDCSTMS-UHFFFAOYSA-N

• 2-Chloro-5-iodobenzoic acid
IUPAC Name: 2-chloro-5-iodobenzoic acid | CAS Registry Number: 19094-56-5
Synonyms: SBB064075, AG-E-39416, PubChem3649, AC1LASRN, ACMC-209eug, SureCN305505, KSC174I1H, 2-Chloro-5-iodo-benzoic acid, 5-Iodo-2-chlorobenzoic acid;, 631736_ALDRICH, Jsp003921, Benzoicacid, 2-chloro-5-iodo-, CTK0H4413, MolPort-000-153-152, ACT07777, BUTTPARK 100\01-43, ANW-23510, STL377354, AKOS002341055, AC-3935

Molecular Formula: C7H4ClIO2Molecular Weight: 282.462930 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: GEBYSTBEDVQOTK-UHFFFAOYSA-N

• 5-Bromo-2-chlorobenzonitrile
IUPAC Name: 5-bromo-2-chlorobenzonitrile | CAS Registry Number: 57381-44-9
Synonyms: 5-bromo-2-chlorobenzonitrile, SBB064462, AG-G-02405, PubChem4695, ACMC-209lxv, SureCN559815, KSC606O6L, Benzonitrile,5-bromo-2-chloro-, CTK5A6765, 1-Bromo-4-chloro-3-cyanobenzene, MolPort-001-768-735, 5-bromo-2-chlorobenzenecarbonitrile, ACT00661, 5-bromo-2-chlorobenzenecarbonitrile;, ANW-32705, WT1792, ZINC02567826, AKOS012323309, AC-4025, AS01617

Molecular Formula: C7H3BrClNMolecular Weight: 216.462420 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: NKDMQBUJOXQVEA-UHFFFAOYSA-N

• 2-(2-Hydroxyethoxy)Phenol
IUPAC Name: 2-(2-hydroxyethoxy)phenol | CAS Registry Number: 4792-78-3
Synonyms: 2-(2-Hydroxyethoxy)phenol, o-(Hydroxyethoxy)phenol, 2-(beta-Hydroxyethoxy)phenol, 232858_ALDRICH, Phenol, 2-(2-hydroxyethoxy)-, ZINC02024478, CID78519, EINECS 225-346-1, Catechol, mono(beta-hydroxyethyl)ether, FR-2213, BBV-2064104, Pyrocatechol mono-(2-hydroxy ethyl)-ether

Molecular Formula: C8H10O3Molecular Weight: 154.163200 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: AMCOCUDBDKVWRZ-UHFFFAOYSA-N

• 2-Bromophenetole
IUPAC Name: 1-bromo-2-ethoxybenzene | CAS Registry Number: 583-19-7
Synonyms: o-Bromophenetole, Benzene, 1-bromo-2-ethoxy-, NSC8054, CID68500, EINECS 209-501-0, ZINC01586377, BBV-070489, AI3-01058

Molecular Formula: C8H9BrOMolecular Weight: 201.060460 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: JVEQWIQHHWNMQX-UHFFFAOYSA-N

• 1 4-Difluorobenzene
IUPAC Name: 1,4-difluorobenzene | CAS Registry Number: 540-36-3
Synonyms: p-Difluorobenzene, Benzene, p-difluoro-, para-Difluorobenzene, 1,4-DIFLUOROBENZENE, Benzene, 1,4-difluoro-, 1,4-Difluorbenzol, 1,4-Difluoro-benzene, WLN: FR DF, D102202_ALDRICH, 442249_SUPELCO, 36910_FLUKA, CHEBI:38585, EINECS 208-742-9, NSC 10286, Benzene, 1,4-difluoro- (9CI), JRD-0119, NSC10286, ZINC00164664, LS-29836, SB 01462

Molecular Formula: C6H4F2Molecular Weight: 114.092766 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: QUGUFLJIAFISSW-UHFFFAOYSA-N

• 1,3-Dimethyl-2-imidazolidinone
IUPAC Name: 1,3-dimethylimidazolidin-2-one | CAS Registry Number: 80-73-9
Synonyms: Karbomos TsEM, Rhonite 1, Dimethylethyleneurea, Dimethyl imidazolidinone, N,N'-Dimethylethyleneurea, DMEU, 1,3-Dimethylethyleneurea, N,N'-Dimethylimidazolidone, N,N'-Dimethylimidazolidinone, 1,3-Dimethylimidazolidin-2-one, 1,3-Dimethyl-2-imidazolidone, 2-IMIDAZOLIDINONE, 1,3-DIMETHYL-, 193453_ALDRICH, 40725_FLUKA, 40727_FLUKA, EINECS 201-304-8, CID6661, BRN 0108808, SBB008346, 2-IMIDAZOLIDONE,1,3-DIMETHYL

Molecular Formula: C5H10N2OMolecular Weight: 114.145700 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: CYSGHNMQYZDMIA-UHFFFAOYSA-N

• 2,4-Dichloro Fluoro Benzene
IUPAC Name: 2,4-dichloro-1-fluorobenzene | CAS Registry Number: 1435-48-9
Synonyms: 1,3-Dichloro-4-fluorobenzene, 2,4-Dichloro-1-fluorobenzene, Benzene,2,4-dichloro-1-fluoro-, 309885_ALDRICH, ZINC00157878, Benzene, 2,4-dichloro-1-fluoro-, CID123112, ST5405403

Molecular Formula: C6H3Cl2FMolecular Weight: 164.992423 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: BDJZCCWUSOZUQG-UHFFFAOYSA-N

• 3-Fluorotoluene
IUPAC Name: 1-fluoro-3-methylbenzene | CAS Registry Number: 352-70-5
Synonyms: Toluene, m-fluoro-, M-FLUOROTOLUENE, 1-Fluoro-3-methylbenzene, 3-Fluorobenzyl radical, 1-Methyl-3-fluorobenzene, Benzene, 1-fluoro-3-methyl-, Ambap7192, Toluene, m-fluoro- (8CI), 162329_ALDRICH, NSC8860, NSC 8860, EINECS 206-524-8, UN2388, m-Fluorotoluene [UN2388] [Flammable liquid], InChI=1/C7H7F/c1-6-3-2-4-7(8)5-6/h2-5H,1H, 2599-73-7

Molecular Formula: C7H7FMolecular Weight: 110.128883 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: BTQZKHUEUDPRST-UHFFFAOYSA-N

• 3-Nitro-4-Fluoro Aniline
IUPAC Name: 4-fluoro-3-nitroaniline | CAS Registry Number: 364-76-1
Synonyms: 4-Fluoro-3-nitroaniline, 3-Nitro-4-fluoroaniline, Aniline, 4-fluoro-3-nitro-, 4-Fluoro-3-nitrobenzenamine, Benzenamine, 4-fluoro-3-nitro-, Ambap1574, 4-Fluoro-3-nitro-aniline, 155861_ALDRICH, CHEBI:48642, EINECS 206-665-5, NSC 10293, ZINC01706159, CID67768, NSC10293, BRN 2210199, LS-19823, TL8002688, 4-12-00-01668 (Beilstein Handbook Reference), InChI=1/C6H5FN2O2/c7-5-2-1-4(8)3-6(5)9(10)11/h1-3H,8H

Molecular Formula: C6H5FN2O2Molecular Weight: 156.114503 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: LLIOADBCFIXIEU-UHFFFAOYSA-N

• 4-Chlorobenzotrifluoride
IUPAC Name: 1-chloro-4-(trifluoromethyl)benzene | CAS Registry Number: 98-56-6
Synonyms: p-Chlorobenzotrifluoride, para-Chlorobenzotrifluoride, p-Chlorotrifluoromethylbenzene, p-Trifluoromethylphenyl chloride, (p-Chlorophenyl)trifluoromethane, p-(Trifluoromethyl)chlorobenzene, p-Chloro-a,a,a-trifluorotoluene, CCRIS 720, Benzene, 1-chloro-4-(trifluoromethyl)-, para-Chlorotrifluoromethylbenzene, C26402_ALDRICH, HSDB 4251, 1-(Trifluoromethyl)-4-chlorobenzene, 1-CHLORO-4-(TRIFLUOROMETHYL)BENZENE, 23720_FLUKA, 4-Chloro-a,a,a-trifluorotoluene, EINECS 202-681-1, NSC 10309, NSC10309, 4-Chloro-alpha,alpha,alpha-trifluorotoluene

Molecular Formula: C7H4ClF3Molecular Weight: 180.554870 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: QULYNCCPRWKEMF-UHFFFAOYSA-N

• 4-Chloro-2-Aminotoluene
IUPAC Name: 5-chloro-2-methylaniline | CAS Registry Number: 95-79-4
Synonyms: Ansibase Red KB, Red KB base, 5-Chloro-2-methylaniline, Pharmazoid Red KB, Fast Red KB base, Lake Red BK base, Spectrolene Red KB, Fast Red KB Salt, Fast Red KB amine, Stable Red KB base, Fast Red KBS Salt, Genazo Red KB Soln, o-Toluidine, 5-chloro-, Lake Red KB Base, 5-Chloroaminotoluene, 2-Amino-4-chlorotoluene, 5-CHLORO-O-TOLUIDINE, Acco Fast Red KB Base, 4-Chloro-2-aminotoluene, 5-Chloro-2-toluidine

Molecular Formula: C7H8ClNMolecular Weight: 141.598120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: WRZOMWDJOLIVQP-UHFFFAOYSA-N

• 4-Fluoroanisole
IUPAC Name: 1-fluoro-4-methoxybenzene | CAS Registry Number: 459-60-9
Synonyms: p-Fluoroanisole, Anisole, p-fluoro-, p-Fluoromethoxybenzene, p-Methoxyfluorobenzene, Benzene, 1-fluoro-4-methoxy-, p-Fluorophenyl methyl ether, F4602_ALDRICH, 1-FLUORO-4-METHOXYBENZENE, Anisole, p-fluoro- (8CI), NSC4672, NSC 4672, EINECS 207-295-7, ZINC00404414, F154, AI3-10595, 3S210941

Molecular Formula: C7H7FOMolecular Weight: 126.128283 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: VIPWUFMFHBIKQI-UHFFFAOYSA-N

• 2-Chloro-4-IodoAniline
IUPAC Name: 2-chloro-4-iodoaniline | CAS Registry Number: 42016-93-3
Synonyms: 2-Chloro-4-iodoaniline, 652679_ALDRICH, ZINC00164206, CID282930, NSC137040, S 01378

Molecular Formula: C6H5ClINMolecular Weight: 253.468070 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: MYDAOWXYGPEPJT-UHFFFAOYSA-N

• 2,5-Diethoxy-4-(4-Morpholinyl)Benzenediazonium Sulfate
IUPAC Name: 2,5-diethoxy-4-morpholin-4-ylbenzenediazonium; hydrogen sulfate | CAS Registry Number: 32178-39-5
Synonyms: EINECS 250-940-2, LS-29643, 4-Morpholino-2,5-diethoxybenzenediazonium sulfate, 2,5-Diethoxy-4-(morpholin-4-yl)benzenediazonium hydrogen sulphate, Benzenediazonium, 2,5-diethoxy-4-(4-morpholinyl)-, sulfate (1:1)

Molecular Formula: C14H21N3O7SMolecular Weight: 375.397440 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 9

InChIKey: OONVERUZTDGMRD-UHFFFAOYSA-M

• 2-Bromo-5-fluorobenzaldehyde
IUPAC Name: 2-bromo-5-fluorobenzaldehyde | CAS Registry Number: 94569-84-3
Synonyms: Ambap832, 528978_ALDRICH, Benzaldehyde, 2-bromo-5-fluoro-, ZINC02512342, CID2773321, TL80074147

Molecular Formula: C7H4BrFOMolecular Weight: 203.008463 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: CJUCIKJLMFVWIS-UHFFFAOYSA-N

• 3-aminophenylboronic Acid Monohydrate
IUPAC Name: (3-aminophenyl)boronic acid;hydrate | CAS Registry Number: 206658-89-1
Synonyms: 3-Aminophenylboronic acid monohydrate, SBB052525, 3-Aminobenzeneboronic acid monohydrate, PubChem4016, ACMC-1CFGG, SureCN295422, 3-Boronoaniline monohydrate, KSC489K7L, AGN-PC-0019EI, 287512_ALDRICH, CTK3I9575, M-aminophenylboronic acid hydrate, 3-Aminophenylboronic acid hydrate, MolPort-001-769-470, 3-Aminobenzeneboronic acid hydrate, (3-aminophenyl)boronic acid hydrate, ACN-S003614, ANW-24181, RW2398, AKOS005259063

Molecular Formula: C6H10BNO3Molecular Weight: 154.959500 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 4

InChIKey: XAEOVQODHLLNKX-UHFFFAOYSA-N

• 2,6-Dimethoxybenzoic Acid
IUPAC Name: 2,6-dimethoxybenzoic acid | CAS Registry Number: 1466-76-8
Synonyms: 2,6-DIMETHOXYBENZOIC ACID, Benzoic acid, 2,6-dimethoxy-, D131601_ALDRICH, EINECS 215-985-4, NSC 28591, AIDS018090, AIDS-018090, NSC28591, LS-37121, ST5213894, InChI=1/C9H10O4/c1-12-6-4-3-5-7(13-2)8(6)9(10)11/h3-5H,1-2H3,(H,10,11

Molecular Formula: C9H10O4Molecular Weight: 182.173300 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: MBIZFBDREVRUHY-UHFFFAOYSA-N

• 3-Methoxyphenylacetic Acid
IUPAC Name: 2-(3-methoxyphenyl)acetic acid | CAS Registry Number: 1798-09-0
Synonyms: m-Methoxyphenylacetic acid, 3-Methoxyphenylacetic acid, (3-Methoxyphenyl)acetic acid, Benzeneacetic acid, 3-methoxy-, 3-Methoxybenzeneacetic acid, M19007_ALDRICH, ACETIC ACID, (m-METHOXYPHENYL)-, EINECS 217-282-8, BRN 2614004, Benzeneacetic acid, 3-methoxy- (9CI), LS-12418, ST5406154, TL80073588, 4-10-00-00541 (Beilstein Handbook Reference), InChI=1/C9H10O3/c1-12-8-4-2-3-7(5-8)6-9(10)11/h2-5H,6H2,1H3,(H,10,11

Molecular Formula: C9H10O3Molecular Weight: 166.173900 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: LEGPZHPSIPPYIO-UHFFFAOYSA-N

• 1,3-Dibromopropane
IUPAC Name: 1,3-dibromopropane | CAS Registry Number: 109-64-8
Synonyms: 1,3-DIBROMOPROPANE, Trimethylene dibromide, Trimethylene bromide, Propane, 1,3-dibromo-, alpha,gamma-Dibromopropane, .alpha.,.gamma.-Dibromopropane, WLN: E3E, CCRIS 6711, EINECS 203-690-3, HSDB 7408, .omega.,.omega.'-Dibromopropane, NSC 62663, 125903_SIAL, NSC62663, AI3-28592, LS-119947, TL8000305, InChI=1/C3H6Br2/c4-2-1-3-5/h1-3H, 625084-38-0

Molecular Formula: C3H6Br2Molecular Weight: 201.887740 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: VEFLKXRACNJHOV-UHFFFAOYSA-N

• 2,4-Diamino-6-Chloro Pyrimidine
IUPAC Name: 6-chloropyrimidine-2,4-diamine | CAS Registry Number: 156-83-2
Synonyms: 4-Chloro-2,6-diaminopyrimidine, 6-Chloro-2,4-diaminopyrimidine, C33204_ALDRICH, 2,4-Diamino-6-chloropyrimidine, 2,6-Diamino-4-chloropyrimidine, 4-chloro-2,6-diamino pyrimidine, NSC8818, AIDS022726, 2,4-Pyrimidinediamine, 6-chloro-, AIDS-022726, EINECS 205-863-9, 2-amino-6-chloro-4-pyrimidinylamine, SBB004123, ZINC00967399, AI3-51949, C-3550, AE-861/30098081

Molecular Formula: C4H5ClN4Molecular Weight: 144.562300 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: QJIUMVUZDYPQRT-UHFFFAOYSA-N

• 2,4-Difluoroaniline
IUPAC Name: 2,4-difluoroaniline | CAS Registry Number: 367-25-9
Synonyms: 2,4-DIFLUOROANILINE, 2,4-Difluroaniline, Benzenamine, 2,4-difluoro-, Aniline, 2,4-difluoro-, 2,4-Difluorobenzenamine, CCRIS 4621, D101400_ALDRICH, 36870_FLUKA, EINECS 206-687-5, NSC 10297, LS-97, NSC10297, BRN 2802556, ZINC00157573, AI3-52650, SDCCGMLS-0066219.P001, NCGC00091684-01, SB 00555, TL8002710, 4-12-00-01112 (Beilstein Handbook Reference)

Molecular Formula: C6H5F2NMolecular Weight: 129.107406 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: CEPCPXLLFXPZGW-UHFFFAOYSA-N

• 2-Bromoethylamine Hydrobromide
IUPAC Name: 2-bromoethanamine hydrobromide | CAS Registry Number: 2576-47-8
Synonyms: 2-Bromoethylamine hydrobromide, Bromoethylamine hydrobromide, AMINOETHYL BROMIDE HBr, WLN: Z2E &EH, B65705_ALDRICH, 2-Aminoethyl bromide hydrobromide, 2-Bromoethanamine hydrobromide, 06670_FLUKA, NSC3379, NSC3406, 2-Bromoethylamine monohydrobromide, .beta.-Bromoethylamine hydrobromide, Ethanamine, 2-bromo-, hydrobromide, ETHYLAMINE, 2-BROMO-, HYDROBROMIDE, ST5331776

Molecular Formula: C2H7Br2NMolecular Weight: 204.891680 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: WJAXXWSZNSFVNG-UHFFFAOYSA-N

• 3,4,5-Trimethoxy Methyl Benzoate
IUPAC Name: methyl 3,4,5-trimethoxybenzoate | CAS Registry Number: 1916-07-0
Synonyms: Methyl tri-O-methylgallate, Methyl 3,4,5-trimethoxybenzoate, Trimethylgallic acid methyl ester, M86006_ALDRICH, 3,4,5-Trimethoxybenzoic acid, methyl ester, EINECS 217-629-3, NSC 16955, NSC16955, BRN 2218156, ZINC00057165, BENZOIC ACID, 3,4,5-TRIMETHOXY-, METHYL ESTER, AI3-21154, LS-38496, METHYL-3,4,5-TRIMETHOXY BENZOATE, 3,4,5-Trimethoxybenzoic acid methyl ester, ST5307960, 4-10-00-01999 (Beilstein Handbook Reference), AF-684/30328043, InChI=1/C11H14O5/c1-13-8-5-7(11(12)16-4)6-9(14-2)10(8)15-3/h5-6H,1-4H

Molecular Formula: C11H14O5Molecular Weight: 226.225860 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: KACHFMOHOPLTNX-UHFFFAOYSA-N

• 4-Chloro-Meta-Cresol
IUPAC Name: 4-chloro-3-methylphenol | CAS Registry Number: 59-50-7
Synonyms: Chlorocresol, 4-Chloro-m-cresol, Candaseptic, Peritonan, Baktolan, Ottafact, Parmetol, Raschit, Baktol, Aptal, Parol, p-Chloro-m-cresol, p-Chlorocresol, Rasen-Anicon, Chlorcresolum, Chlorkresolum, Chlorocresolo, Chlorokresolum, 4-Chloro-3-methylphenol, Preventol CMK

Molecular Formula: C7H7ClOMolecular Weight: 142.582880 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: CFKMVGJGLGKFKI-UHFFFAOYSA-N

• 5-Methoxylindole
IUPAC Name: 5-methoxy-1H-indole | CAS Registry Number: 1006-94-6
Synonyms: Femedol, 5-Methoxy-1H-indole, 5-METHOXYINDOLE, Indole, 5-methoxy-, 1H-Indole, 5-methoxy-, Methoxy-5 indole, Indol-5-yl methyl ether, Methoxy-5 indole [French], M14900_ALDRICH, 1H-Indol-5-yl methyl ether, Methoxy-5 indole [French], WLN: T56 BMJ GO1, EINECS 213-745-3, 1H-Indole, 5-methoxy- (9CI), NSC 521752, CID13872, NSC521752, SBB004094, ZINC00158156, M2323G1

Molecular Formula: C9H9NOMolecular Weight: 147.173860 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: DWAQDRSOVMLGRQ-UHFFFAOYSA-N

• 2,4-dichloro-5-methoxyaniline
IUPAC Name: 2,4-dichloro-5-methoxyaniline | CAS Registry Number: 98446-49-2
Synonyms: MLS000707240, ZINC01388874, 4L-348S, CID1476636, SMR000334622

Molecular Formula: C7H7Cl2NOMolecular Weight: 192.042580 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: AJROJTARXSATEB-UHFFFAOYSA-N

• 2-Iodo-5-Methylbenzoic Acid
IUPAC Name: 2-iodo-5-methylbenzoic acid | CAS Registry Number: 52548-14-8
Synonyms: Maybridge3_000657, 2-Iodo-5-methylbenzoic acid, 5-Methyl-2-iodobenzoic acid, BTB11559, CID142941, IDI1_012044, TL8003460, SR-01000643458-1

Molecular Formula: C8H7IO2Molecular Weight: 262.044450 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: INGWGCDYAJKXKP-UHFFFAOYSA-N

• 3,5-Dibromofluorobenzene
IUPAC Name: 1,3-dibromo-5-fluorobenzene | CAS Registry Number: 1435-51-4
Synonyms: 1,3-Dibromo-5-fluorobenzene, 3,5-Dibromo-1-fluorobenzene, 368121_ALDRICH, ST5405503, TL80074056, InChI=1/C6H3Br2F/c7-4-1-5(8)3-6(9)2-4/h1-3

Molecular Formula: C6H3Br2FMolecular Weight: 253.894423 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: ASWYHZXKFSLNLN-UHFFFAOYSA-N

• 2',4'-Difluoroacetophenone
IUPAC Name: 1-(2,4-difluorophenyl)ethanone | CAS Registry Number: 364-83-0
Synonyms: Acetophenone, 2',4'-difluoro-, 264253_ALDRICH, Ethanone, 1-(2,4-difluorophenyl)-, 36863_FLUKA, ZINC00157303, CID67770, EINECS 206-667-6, 1-(2,4-Difluorophenyl)ethan-1-one, TL806298, T5792202

Molecular Formula: C8H6F2OMolecular Weight: 156.129446 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: QEWHNJPLPZOEKU-UHFFFAOYSA-N

• 2,5-Difluoroacetophenone
IUPAC Name: 1-(2,5-difluorophenyl)ethanone | CAS Registry Number: 1979-36-8
Synonyms: 2',5'-Difluoroacetophenone, 2',5'-Difloroacetophenone, 264261_ALDRICH, ZINC01995083, CID74794, JRD-0242, EINECS 217-837-4, SBB006573, 1-(2,5-Difluorophenyl)ethan-1-one

Molecular Formula: C8H6F2OMolecular Weight: 156.129446 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: HLAFIZUVVWJAKL-UHFFFAOYSA-N

• 3,4-Difluorobenzaldehyde
IUPAC Name: 3,4-difluorobenzaldehyde | CAS Registry Number: 34036-07-2
Synonyms: 265160_ALDRICH, ZINC00164803, JRD-0104, CID588088, SB 01773, TL8002544, InChI=1/C7H4F2O/c8-6-2-1-5(4-10)3-7(6)9/h1-4

Molecular Formula: C7H4F2OMolecular Weight: 142.102866 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: JPHKMYXKNKLNDF-UHFFFAOYSA-N

• 3,5-Difluorobenzaldehyde
IUPAC Name: 3,5-difluorobenzaldehyde | CAS Registry Number: 32085-88-4
Synonyms: 290173_ALDRICH, ZINC00164753, JRD-0258, CID588160, SB 01678

Molecular Formula: C7H4F2OMolecular Weight: 142.102866 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: ASOFZHSTJHGQDT-UHFFFAOYSA-N

• 2,5-Difluorostyrene
IUPAC Name: 2-ethenyl-1,4-difluorobenzene | CAS Registry Number: 305371-97-5
Synonyms: 1,4-difluoro-2-vinylbenzene, 2-ethenyl-1,4-difluorobenzene, 1,4-Difluoro-2-vinyl-benzene, 2,5-Difluorostyrene;, SureCN491580, CTK1C2034, MolPort-002-317-231, PC6275, SBB086130, 2-ethenyl-1,4-bis(fluoranyl)benzene, AKOS006281195, AG-F-00725, AS03798, KB-17958, FT-0690894, A820422, I01-9843

Molecular Formula: C8H6F2Molecular Weight: 140.130046 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: DSIWLDCXHHMNQL-UHFFFAOYSA-N

• 1,2,3-Tribromopropane
IUPAC Name: 1,2,3-tribromopropane | CAS Registry Number: 96-11-7
Synonyms: s-Tribromopropane, sym-Tribromopropane, Glycerol tribromohydrin, Glyceryl tribromohydrin, 1,2,3-TRIBROMOPROPANE, Propane, 1,2,3-tribromo-, CCRIS 6706, NCIOpen2_004459, 148474_ALDRICH, CHEBI:18859, EINECS 202-478-8, NSC 78932, NSC78932, BRN 1732082, c0622, AI3-18135, LS-121073, ST5409751, 4-01-00-00221 (Beilstein Handbook Reference), InChI=1/C3H5Br3/c4-1-3(6)2-5/h3H,1-2H

Molecular Formula: C3H5Br3Molecular Weight: 280.783800 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: FHCLGDLYRUPKAM-UHFFFAOYSA-N

• 2-Bromo Phenol
IUPAC Name: 2-bromophenol | CAS Registry Number: 95-56-7
Synonyms: o-Bromophenol, 2-BROMOPHENOL, Phenol, 2-bromo-, Phenol, o-bromo-, BROMOPHENOL, Phenol, bromo-, o-bromo-phenol, 2-Bromfenol, 2-Bromfenol [Czech], WLN: QR BE, 130915_ALDRICH, 36942_RIEDEL, NSC 6970, 17990_FLUKA, EINECS 202-432-7, EINECS 251-200-1, NSC6970, BRN 1905115, ZINC00388200, DB04586

Molecular Formula: C6H5BrOMolecular Weight: 173.007300 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: VADKRMSMGWJZCF-UHFFFAOYSA-N


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