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Chem-Is-Try Inc.

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Profile: Chem-Is-Try Inc. deals with specialty chemicals. We provide services such as custom synthesis, contract R&D, laboratory & industrial scale production and custom manufacturing services. We specialize in fine chemicals, organic intermediates and bulk chemicals. Our products include acenaphthequinone, 2-(acetoxymethyl)-4-methoxy-3,5 dimethylpyridine, n-acetyl(2-aminoethyl)benzenesulphonamide, 3-acetyl-2,5-dichlorothiophene, 1-acetyl-4-(4-hydroxyphenyl)piperazine, 3'-aminoacetophenone, 3-aminobenzoic acid, 2-bromo-6-methoxynaphthalene, 4-chlorotetrahydropyran and 1-ethyl-2-methylindole.

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• 4-Methyl-2-(methylthio)pyrimidine
IUPAC Name: 4-methyl-2-methylsulfanylpyrimidine | CAS Registry Number: 14001-63-9
Synonyms: 674885_ALDRICH, ZINC00338008, CID821261, methyl 4-methyl-2-pyrimidinyl sulfide, ST5409732, AR-527/42979548

Molecular Formula: C6H8N2SMolecular Weight: 140.206120 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: UCERVHYBSTYCQS-UHFFFAOYSA-N

• 3-Methoxy-2-Methyl-4-(1h)-Pyridone
IUPAC Name: 3-methoxy-2-methyl-1H-pyridin-4-one | CAS Registry Number: 76015-11-7
Synonyms: 542164_ALDRICH, 3-Methoxy-2-methyl-4-pyridinol, NSC283471, 4-Pyridinol, 3-methoxy-2-methyl-, CID323424, 3-Methoxy-2-methyl-1H-pyridin-4-one

Molecular Formula: C7H9NO2Molecular Weight: 139.151860 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: GNWSQENQZGWCSW-UHFFFAOYSA-N

• 2-Nitro Diphenyl Sulphide
IUPAC Name: 1-nitro-2-phenylsulfanylbenzene | CAS Registry Number: 4171-83-9
Synonyms: 2-Nitrodiphenyl sulfide, 2NO2Ph-S-Ph, 2-Nitrophenyl phenyl sulfide, Sulfide, o-nitrophenyl phenyl, 1-nitro-2-phenylsulfanylbenzene, Benzene, 1-nitro-2-(phenylthio)-, NSC633005, AIDS005728, AIDS160495, AIDS-005728, AIDS-160495, NSC408025, ZINC00581316, Hydroxy(2-(phenylthio)phenyl)azane oxide

Molecular Formula: C12H9NO2SMolecular Weight: 231.270360 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: ZPWNCSAEXUDWTN-UHFFFAOYSA-N

• 2,2'-Dithiosalicylic Acid
IUPAC Name: 2-(2-carboxyphenyl)disulfanylbenzoic acid | CAS Registry Number: 119-80-2
Synonyms: Dithiosalicylic acid, 2,2'-Dithiodibenzoic acid, Bis(2-carboxyphenyl) disulfide, 2-Carboxyphenyl disulfide, Bis(o-carboxylphenyl) disulfide, Disulfide benzamide analog, Benzoic acid, 2,2'-dithiobis-, Bis(o-carboxyphenyl) disulfide, 2,2'-Dithiodi(benzoic acid), 2,2'-Dithiosalicylic acid, NSC213, 2,2'-Dithiobis(benzoic acid), MLS001216615, NSC 213, NSC5346, 2,2'-Dithiobis[benzoic acid], 389285_ALDRICH, NSC 5346, 43761_FLUKA, BENZOIC ACID, 2,2'-DITHIODI-

Molecular Formula: C14H10O4S2Molecular Weight: 306.356800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: LBEMXJWGHIEXRA-UHFFFAOYSA-N

• 3,4-Dimethylphenylhydrazine HCL
IUPAC Name: (3,4-dimethylphenyl)hydrazine | CAS Registry Number: 60481-51-8
Synonyms: (3,4-dimethylphenyl)hydrazine, ZINC00153203, ALBB-005974, CID173741, BBV-048345

Molecular Formula: C8H12N2Molecular Weight: 136.194280 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: ACHREEHAAAECOR-UHFFFAOYSA-N

• 3,5-Difluoro Acetophenone
IUPAC Name: 1-(3,5-difluorophenyl)ethanone | CAS Registry Number: 123577-99-1
Synonyms: 3,5-Difluoroacetophenone, 1-(3,5-Difluorophenyl)ethanone, 3',5'-Difluoroacetophenone, 541168_ALDRICH, ZINC02584338, ALBB-006378, CID518596, TL8000630

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

InChIKey: OXJLDNSPGPBDCP-UHFFFAOYSA-N

• 2-mercaptopyridine
IUPAC Name: 1H-pyridine-2-thione | CAS Registry Number: 2637-34-5
Synonyms: 2-Pyridinethiol, Pyrid-2-thione, 2-Mercaptopyridine, 2-Thiopyridine, Pyridinethione, Pyridine-2-thiol, 2-Thiopyridone, 2-Pyridinethione, 2-Pyridyl mercaptan, 2(1H)-PYRIDINETHIONE, Thiopyridone-2 [French], WLN: T6NJ BSH, M5852_ALDRICH, EINECS 220-131-9, NSC 41337, AIDS022106, AIDS-022106, NSC41337, EINECS 249-657-7, LS-132090

Molecular Formula: C5H5NSMolecular Weight: 111.164900 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 0

InChIKey: WHMDPDGBKYUEMW-UHFFFAOYSA-N

• 4-(3-Methylphenyl)amino-3-PyridineSulfonamide
IUPAC Name: 4-(3-methylanilino)pyridine-3-sulfonamide | CAS Registry Number: 72811-73-5
Synonyms: 4-(3'-methylphenyl)amino-3-pyridinesulfonamide, 4-[(3-methylphenyl)amino]pyridine-3-sulfonamide, 4-(m-Tolylamino)pyridine-3-sulfonamide, 4-(3-toluidino)pyridine-3-sulfonamide, 3-Sulfonamido-4-(3-methylanilino)pyridine, 4-(3-Methylphenyl)Amino-3-Pyridinesulfonamide, 4-(-3-Methylphenyl)amino-3-pyridinesulfonamide, AJ-333/25006115, 4-((3-Methylphenyl)amino)-3-pyridinesulfonamide, 4-[(3-Methylphenyl)amino]-3-pyridinesulfonamide, ZINC00334942, AC1Q6UVL, AC1LGD84, SureCN2876602, Torsemide related compound A, UNII-7GN70NEN27, KSC496S2B, MLS001180446, CTK3J6920, MolPort-003-802-481

Molecular Formula: C12H13N3O2SMolecular Weight: 263.315520 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: ZXPCUGWAKUIOOF-UHFFFAOYSA-N

• 1-Bis(4-Fluorophenyl)methyl Piperazine
IUPAC Name: 1-[bis(4-fluorophenyl)methyl]piperazine | CAS Registry Number: 27469-60-9
Synonyms: 552402_ALDRICH, 94896_FLUKA, ALBB-006009, EINECS 248-476-0, SBB002996, 1-(4,4'-Difluorobenzhydryl)piperazine, 1-Bis(4-fluorophenyl)methyl piperazine, 1-(Bis(4-fluorophenyl)methyl)piperazine, 1-[bis(4-fluorophenyl)methyl]piperazine, N-(Bis(4-fluorophenyl)methyl)piperazine, TL8002211

Molecular Formula: C17H18F2N2Molecular Weight: 288.335026 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: TTXIFFYPVGWLSE-UHFFFAOYSA-N

• 1,2-Chloroethyl Piperidine HCl
IUPAC Name: 1-(2-chloroethyl)piperidine hydrochloride | CAS Registry Number: 2008-75-5
Synonyms: Ambap7519, C42602_ALDRICH, Piperidinoethyl chloride, hydrochloride, NSC 9995, EINECS 217-920-5, NSC9995, NSC 30790, 1-(2-Chloroethyl)piperidine hydrochloride, 1-(2-Chloroethyl)piperidinium chloride, beta-Chloroethylpiperidine hydrochloride, CID74826, NSC30790, 2-Piperidinoethylchloride hydrochloride, Piperidine, 1-(2-chloroethyl)-, hydrochloride, 2-Piperidinoethyl chloride hydrochloride, N-(beta-CHLOROETHYL)PIPERIDINE HCI, LS-114795, TL8001656

Molecular Formula: C7H15Cl2NMolecular Weight: 184.106700 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: VFLQQZCRHPIGJU-UHFFFAOYSA-N

• 2-Mercapto-4-methylpyrimidine hydrochloride
IUPAC Name: 6-methyl-1H-pyrimidine-2-thione chloride | CAS Registry Number: 6959-66-6
Synonyms: EINECS 230-152-5, NSC65435, CID3083988, 4-Methylpyrimidine-2-thiol hydrochloride

Molecular Formula: C5H6ClN2S-Molecular Weight: 161.632540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: UQJLPBLXSJWAKG-UHFFFAOYSA-M

• 3-(1-Cyanoethyl) Benzoic Acid (Ceba)
IUPAC Name: 3-(1-cyanoethyl)benzoic acid | CAS Registry Number: 5537-71-3
Synonyms: m-(1-Cyanoethyl)benzoic acid, 3-(1-Cyanoethyl)benzoic acid, 209805_ALDRICH, Benzoic acid, 3-(1-cyanoethyl)-, EINECS 226-897-0, NSC113992

Molecular Formula: C10H9NO2Molecular Weight: 175.183960 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: IRYIYPWRXROPSX-UHFFFAOYSA-N

• 2-(Diisopropylamino)-ethylchloride-hydrochloride
IUPAC Name: N-(2-chloroethyl)-N-propan-2-ylpropan-2-amine hydrochloride | CAS Registry Number: 4261-68-1
Synonyms: D125202_ALDRICH, 38330_FLUKA, EINECS 224-238-1, NSC 49189, NSC49189, 2-(Diisopropylamino)ethyl chloride hydrochloride, 2-Chloroethyldiisopropylammonium chloride, 2-Chloroethyldiisopropylamine hydrochloride, AI3-26685, N-(Chloroethyl)diisopropylamine hydrochloride, (beta-Chloroethyl)diisopropylamine hydrochloride, Diisopropylamine, N-(2-chloroethyl)-, hydrochloride, LS-119418, beta-DIISOPROPYLAMINOETHYL CHLORIDE HCl, N-(2-Chloroethyl)diisopropylamine hydrochloride, 2-Chloro-N,N-diisopropylethylamine hydrochloride, Triethylamine, 2''-chloro-1,1'-dimethyl-, hydrochloride, 2-Propanamine, N-(2-chloroethyl)-N-(1-methylethyl)-, hydrochloride, N-(2-Chloroethyl)-N-(1-methylethyl)-2-propanamine hydrochloride, Triethylamine, 2''-chloro-1,1'-dimethyl-, hydrochloride (8CI)

Molecular Formula: C8H19Cl2NMolecular Weight: 200.149160 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: IUSXYVRFJVAVOB-UHFFFAOYSA-N

• 1H-Imidazole-4-ylmethanol hydrochloride
IUPAC Name: 1H-imidazol-5-ylmethanol hydrochloride | CAS Registry Number: 32673-41-9
Synonyms: 4-Imidazolemethanol hydrochloride, MLS000069480, H1877_SIGMA, 219908_ALDRICH, Imidazol-4-ylmethanol hydrochloride, EINECS 251-150-0, SBB004207, H2067G1, 4-(HYDROXYMETHYL)IMIDAZOLE HYDROCHLORIDE, NCGC00093979-01, SMR000059084, EU-0100603

Molecular Formula: C4H7ClN2OMolecular Weight: 134.564180 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: WFNASTYGEKUMIY-UHFFFAOYSA-N

• 3-Chloro-2,5-dimethylpyrazine
IUPAC Name: 3-chloro-2,5-dimethylpyrazine | CAS Registry Number: 95-89-6
Synonyms: C38400_ALDRICH, Pyrazine, 3-chloro-2,5-dimethyl-, NSC40820, EINECS 202-463-6, CID66771, LS-127597

Molecular Formula: C6H7ClN2Molecular Weight: 142.586180 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: NNBALVIZMGWZHS-UHFFFAOYSA-N

• 5-Fluoroisatin
IUPAC Name: 5-fluoro-1H-indole-2,3-dione | CAS Registry Number: 443-69-6
Synonyms: Isatin-based compound, 32, 5-Fluoro-1H-indole-2,3-dione, 366978_ALDRICH, ZERO/000347, AIDS163137, AIDS-163137, ALBB-002980, NSC39161, ZINC01671161, TL8003090, F-5600

Molecular Formula: C8H4FNO2Molecular Weight: 165.121263 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: GKODDAXOSGGARJ-UHFFFAOYSA-N

• 3,3'-Dinitrobenzophenone
IUPAC Name: bis(3-nitrophenyl)methanone | CAS Registry Number: 21222-05-9
Synonyms: Methanone, bis(3-nitrophenyl)-, Bis(3-nitrophenyl)methanone, NCIOpen2_004917, Oprea1_414356, 411787_ALDRICH, NSC86515, BENZOPHENONE,3,3'-DINITRO, CID96690, NSC 86515, ZINC01556184, Methanone, bis(3-nitrophenyl)- (9CI), A2375/0100449, InChI=1/C13H8N2O5/c16-13(9-3-1-5-11(7-9)14(17)18)10-4-2-6-12(8-10)15(19)20/h1-8

Molecular Formula: C13H8N2O5Molecular Weight: 272.213020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: BSDKBWGNIJMCID-UHFFFAOYSA-N

• 2-Bromo-6-Methoxy Naphthalene
IUPAC Name: 2-bromo-6-methoxynaphthalene | CAS Registry Number: 5111-65-9
Synonyms: 2-Bromo-6-methoxynaphthalene, Naphthalene, 2-bromo-6-methoxy-, 6-Methoxy-2-bromonaphthalene, 6-Bromo-2-naphthylmethylether, NSC3236, 200174_ALDRICH, 17540_FLUKA, CID78786, NSC 3236, EINECS 225-837-0, ZINC00164677, AI3-18465, ST5308358, InChI=1/C11H9BrO/c1-13-11-5-3-8-6-10(12)4-2-9(8)7-11/h2-7H,1H

Molecular Formula: C11H9BrOMolecular Weight: 237.092560 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: AYFJBMBVXWNYLT-UHFFFAOYSA-N

• 3-Amino Acetophenone
IUPAC Name: 1-(3-aminophenyl)ethanone | CAS Registry Number: 99-03-6
Synonyms: 3-Acetylaniline, m-Aminoacetophenone, m-Acetylaniline, m-Aminoacetylbenzene, 3'-Aminoacetophenone, Acetophenone, 3'-amino-, 1-(3-Aminophenyl)ethanone, beta-Aminoacetophenone, Acetophenone, m-amino-, Ethanone, 1-(3-aminophenyl)-, 3-AMINOACETOPHENONE, Ambap7453, 3-Aminoacetofenon [Czech], .beta.-Aminoacetophenone, WLN: ZR CV1, ACETOPHENONE,3-AMINO, 139351_ALDRICH, NSC 7637, 06629_FLUKA, 06630_FLUKA

Molecular Formula: C8H9NOMolecular Weight: 135.163160 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: CKQHAYFOPRIUOM-UHFFFAOYSA-N

• 3-Bromo Benzaldehyde
IUPAC Name: 3-bromobenzaldehyde | CAS Registry Number: 3132-99-8
Synonyms: 3-Bromobenzaldehyde, m-Bromobenzaldehyde, Benzaldehyde, 3-bromo-, Benzaldehyde, m-bromo-, B57206_ALDRICH, EINECS 221-526-9, NSC 66828, NSC66828, ZINC02504374, Benzaldehyde, m-bromo- (6CI,7CI,8CI), LS-2136, NCGC00091295-01, TL806134, ST5213334, B-5781, InChI=1/C7H5BrO/c8-7-3-1-2-6(4-7)5-9/h1-5

Molecular Formula: C7H5BrOMolecular Weight: 185.018000 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: SUISZCALMBHJQX-UHFFFAOYSA-N

• 9-Fluorenylmethyl Chloroformate (FMOC-CL)
IUPAC Name: 9H-fluoren-9-ylmethyl carbonochloridate | CAS Registry Number: 28920-43-6
Synonyms: Fmoc chloride, Fmoc-Cl, Ambap7209, 9-Fluorenylmethyl chloroformate, CCRIS 2608, Fluoren-9-ylmethyl chloroformate, 160512_ALDRICH, 23184_FLUKA, 23186_FLUKA, 9H-Fluoren-9-ylmethyl chloroformate, EINECS 249-313-6, 1-(9-Fluorenyl)methyl chloroformate, 9-Fluorenylmethoxycarbonyl chloride, 9-Fluorenylmethyloxycarbonylchloride, BRN 2279177, ZINC00388382, LS-69673, Carbonochloridic acid, 9H-fluoren-9-ylmethyl ester, TL8007019, FORMIC ACID, CHLORO-, FLUOREN-9-YLMETHYL ESTER

Molecular Formula: C15H11ClO2Molecular Weight: 258.699640 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: IRXSLJNXXZKURP-UHFFFAOYSA-N

• 2-Nitro-4-cyanophenol
IUPAC Name: 4-hydroxy-3-nitrobenzonitrile | CAS Registry Number: 3272-08-0
Synonyms: Ambap3587, 4-Hydroxy-3-nitrobenzonitrile, 344575_ALDRICH, Benzonitrile, 4-hydroxy-3-nitro-, EINECS 221-899-8, ST5405831, InChI=1/C7H4N2O3/c8-4-5-1-2-7(10)6(3-5)9(11)12/h1-3,10

Molecular Formula: C7H4N2O3Molecular Weight: 164.118260 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: INBLGVOPOSGVTA-UHFFFAOYSA-N

• 3-Amino-3-azabicyclo[3.3.0]octane hydrochloride
IUPAC Name: 3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-amine hydrochloride | CAS Registry Number: 58108-05-7
Synonyms: 522341_ALDRICH, EINECS 261-131-9, SBB003933, Hexahydrocyclopenta(c)pyrrol-2(1H)-amine monohydrochloride, Cyclopenta(c)pyrrol-2(1H)-amine, hexahydro-, monohydrochloride

Molecular Formula: C7H15ClN2Molecular Weight: 162.660400 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: WPYNXKFLSQEEFE-UHFFFAOYSA-N

• 5-bromo-2-chlorobenzoic acid
IUPAC Name: 5-bromo-2-chlorobenzoic acid | CAS Registry Number: 21739-92-4
Synonyms: 5-Bromo-2-chlorobenzoic acid, 175544_ALDRICH, Benzoic acid, 5-bromo-2-chloro-, EINECS 244-558-5, TL806385, ST5308565, InChI=1/C7H4BrClO2/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3H,(H,10,11

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

InChIKey: FGERXQWKKIVFQG-UHFFFAOYSA-N

• 2-Amino-3-Chloro Benzoic Acid
IUPAC Name: 2-amino-3-chlorobenzoic acid | CAS Registry Number: 6388-47-2
Synonyms: 2-Amino-3-chlorobenzoic acid, 3-Chloroanthranilic acid, Anthranilic acid, 3-chloro-, 362271_ALDRICH, Benzoic acid, 2-amino-3-chloro-, NSC20671, EINECS 228-996-4, SBB003844, TL8007342, InChI=1/C7H6ClNO2/c8-5-3-1-2-4(6(5)9)7(10)11/h1-3H,9H2,(H,10,11

Molecular Formula: C7H6ClNO2Molecular Weight: 171.581040 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: LWUAMROXVQLJKA-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: C6H4ClNO2Molecular Weight: 157.554460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: UAWMVMPAYRWUFX-UHFFFAOYSA-N

• 4-imidazolemethanol
IUPAC Name: 1H-imidazol-5-ylmethanol | CAS Registry Number: 822-55-9
Synonyms: IMIDAZOLE-4-METHANOL, 1H-Imidazole-4-methanol, 4-(Hydroxymethyl)imidazole, 1H-Imidazol-4-ylmethanol, Lopac-H-1877, 1H-imidazol-5-ylmethanol, Lopac0_000603, (3H-Imidazol-4-yl)-methanol, 4(5)-(Hydroxymethyl)imidazole, 576182_ALDRICH, 4-Imidazolemethanol hydrochloride, CHEBI:28182, 1H-Imidazole-4-methanol (9CI), AIDS019711, AIDS-019711, ZINC00895781, ZINC03861563, NCGC00015502-01, NCGC00093363-02, LS-78744

Molecular Formula: C4H6N2OMolecular Weight: 98.103240 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: QDYTUZCWBJRHKK-UHFFFAOYSA-N

• 4-Bromobenzophenone
IUPAC Name: (4-bromophenyl)-phenylmethanone | CAS Registry Number: 90-90-4
Synonyms: p-Bromobenzophenone, p-Benzoylbromobenzene, USAF DO-3, BENZOPHENONE, 4-BROMO-, 4-Bromophenyl phenyl ketone, WLN: ER DVR, Methanone, (4-bromophenyl)phenyl-, NCIOpen2_002517, B58601_ALDRICH, EINECS 202-024-9, (4-Bromophenyl)(phenyl)methanone, NSC 59863, AIDS017955, AIDS-017955, NSC59863, BRN 1910182, ZINC00154641, LS-38876, Methanone, (4-bromophenyl)phenyl- (9CI), 4-07-00-01378 (Beilstein Handbook Reference)

Molecular Formula: C13H9BrOMolecular Weight: 261.113960 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: KEOLYBMGRQYQTN-UHFFFAOYSA-N

• 5-Bromo-2-Hydroxy Pyridine
IUPAC Name: 5-bromo-1H-pyridin-2-one | CAS Registry Number: 13466-38-1
Synonyms: 5-bromopyridin-2-ol, 2-pyridinol, 5-bromo-, 5-bromopyridin-2(1H)-one, 3-Bromo-6-hydroxypyridine, Pyridin-2-ol, 5-bromo-, 5-Bromo-2(1H)-pyridone, MLS000084659, 528226_ALDRICH, 2(1H)-Pyridinone, 5-bromo-, SBB003806, ZINC00174832, B199, SMR000019007, ST5408663, AG-690/11353091, InChI=1/C5H4BrNO/c6-4-1-2-5(8)7-3-4/h1-3H,(H,7,8

Molecular Formula: C5H4BrNOMolecular Weight: 173.995360 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: NDMZZQRNZFWMEZ-UHFFFAOYSA-N

• 2-Amino-6-chloropyridine
IUPAC Name: 6-chloropyridin-2-amine | CAS Registry Number: 45644-21-1
Synonyms: 2-Chloro-6-aminopyridine, 2-Pyridinamine, 6-chloro-, 6-chloropyridin-2-ylamine, Pyridine, 2-amino-6-chloro-, BRN 0108669, SL-02139, LS-130218, TL8006935, 4-22-00-04028 (Beilstein Handbook Reference), AC-907/25004401

Molecular Formula: C5H5ClN2Molecular Weight: 128.559600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: OBYJTLDIQBWBHM-UHFFFAOYSA-N

• 2-Iodoimidazole
IUPAC Name: 2-iodo-1H-imidazole | CAS Registry Number: 3034-62-6
Synonyms: sFtHEaVILiluH@, 641081_ALDRICH, ZINC02531019, TL8002340

Molecular Formula: C3H3IN2Molecular Weight: 193.973790 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: MHHDMDLNVVCTAJ-UHFFFAOYSA-N

• 4,5-Dimethyl-2-ethylthiazole
IUPAC Name: 2-ethyl-4,5-dimethyl-1,3-thiazole | CAS Registry Number: 873-64-3
Synonyms: 2-Ethyl-4,5-dimethylthiazole, 2-Ethyl-4,5-dimethyl-1,3-thiazole, Thiazole, 2-ethyl-4,5-dimethyl-, 2-ethyl, ZINC02510290, ACMC-209qju, AC1LAXI4, SureCN115387, 556718_ALDRICH, 2-ethyl-4,5-dimethyl thiazole, 4,5-Dimethyl-2-ethyl thiazole, CTK3J5987, MolPort-000-154-808, ANW-38680, AKOS006341292, AG-H-52483, AK-89659, KB-170329, E0718, FT-0657755

Molecular Formula: C7H11NSMolecular Weight: 141.233940 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: BVOKJOZBJOWZNJ-UHFFFAOYSA-N

• 3-Amino-1-(2,4,6-trichlorophenyl)-2-pyrazolin-5-one
IUPAC Name: 5-amino-2-(2,4,6-trichlorophenyl)-4H-pyrazol-3-one | CAS Registry Number: 27241-31-2
Synonyms: NSC113482, SBB003027, ZINC00056873, 1-(2,4,6-Trichlorophenyl)-3-anilinopyrazolone, 3-Amino-1-(2,4,6-trichlorophenyl)-5-pyrazolone, 2-Pyrazolin-5-one, 3-amino-1-(2,4,6-trichlorophenyl)-, 3H-Pyrazol-3-one, 5-amino-2,4-dihydro-2-(2,4,6-trichlorophenyl)-

Molecular Formula: C9H6Cl3N3OMolecular Weight: 278.522440 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: FOGGKKWSFIESMZ-UHFFFAOYSA-N

• 4-Chlorophenyl methyl sulfone
IUPAC Name: 1-chloro-4-methylsulfonylbenzene | CAS Registry Number: 98-57-7
Synonyms: p-Chlorophenyl methyl sulfone, Sulfone, p-chlorophenyl methyl, Methyl 4-chlorophenyl sulfone, Maybridge1_004357, Methyl p-chlorophenyl sulfone, CCRIS 6733, Benzene, 1-chloro-4-(methylsulfonyl)-, 549037_ALDRICH, EINECS 202-682-7, 1-CHLORO-4-(METHYLSULFONYL)BENZENE, 1-Chloro-4-(methylsulphonyl)benzene, NSC 74456, NSC74456, BRN 0638281, SBB006326, ZINC00075300, NCGC00164204-01, LS-147989, TL8006879, 4-06-00-01582 (Beilstein Handbook Reference)

Molecular Formula: C7H7ClO2SMolecular Weight: 190.647280 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: LMCOQDVJBWVNNI-UHFFFAOYSA-N

• 4-Aminobenzonitrile
IUPAC Name: 4-aminobenzonitrile | CAS Registry Number: 873-74-5
Synonyms: 4-Cyanoaniline, p-Cyanoaniline, Benzonitrile, 4-amino-, Aniline, p-cyano-, Benzonitrile, p-amino-, P-AMINOBENZONITRILE, 1-Amino-4-cyanobenzene, para-aminobenzonitrile, WLN: ZR DCN, 147753_ALDRICH, C7H6N2, Benzonitrile, p-amino- (8CI), NSC 7625, 07010_FLUKA, EINECS 212-850-1, NSC7625, AIDS020236, AIDS-020236, BRN 0774507, BENZOIC ACID,4-AMINO,NITRILE

Molecular Formula: C7H6N2Molecular Weight: 118.135940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YBAZINRZQSAIAY-UHFFFAOYSA-N

• 4-Chloro-3-Sulfamoyl Benzoic Acid
IUPAC Name: 4-chloro-3-sulfamoylbenzoic acid | CAS Registry Number: 1205-30-7
Synonyms: CSBA, 4-Chloro-3-sulfamoylbenzoic acid, Sulfamido-3-chlorobenzoic acid, Oprea1_356117, 4-Chloro-5-sulphamoylbenzoic acid, 293598_ALDRICH, EINECS 214-882-1, CID14568, BRN 2118346, Benzoic acid, 3-(aminosulfonyl)-4-chloro-, BENZOIC ACID, 4-CHLORO-3-SULFAMOYL-, LS-36653, TL806358, ST5319885

Molecular Formula: C7H6ClNO4SMolecular Weight: 235.644840 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: FHQAWINGVCDTTG-UHFFFAOYSA-N

• 4-Amino-3-Nitro Benzophenone
IUPAC Name: (4-amino-3-nitrophenyl)-phenylmethanone | CAS Registry Number: 31431-19-3
Synonyms: 4-Amino-3-nitrobenzophenone, 211753_ALDRICH, ZINC03861499, EINECS 250-631-2, CID596970, SBB000820, (4-amino-3-nitrophenyl)phenyl-methanone, Methanone, (4-amino-3-nitrophenyl)phenyl-, ST5308433, TL8002404, 5181-73-7

Molecular Formula: C13H10N2O3Molecular Weight: 242.230100 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: NGOOFAMQPUEDJM-UHFFFAOYSA-N

• 4,4'-diaminodiphenylamine sulfate
IUPAC Name: 1-N-(4-aminophenyl)benzene-1,4-diamine; sulfuric acid | CAS Registry Number: 53760-27-3
Synonyms: D16207_ALDRICH, 4,4'-Iminodianiline sulfate salt, EINECS 258-748-0, 4,4'-Diaminodiphenylamine sulfate salt, 4,4'-DIAMINODIPHENYLAMINE SULFATE, TECH, N-(4-Aminophenyl)benzene-1,4-diamine sulphate (1:1), 6369-04-6

Molecular Formula: C12H15N3O4SMolecular Weight: 297.330200 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 7

InChIKey: OOZQLPDAELLDNY-UHFFFAOYSA-N

• 4-(3-chloropropyl)-morpholine
IUPAC Name: 4-(3-chloropropyl)morpholine | CAS Registry Number: 7357-67-7
Synonyms: 3-Morpholinopropyl chloride, 1-Chloro-3-morpholinopropane, N-(3-Chloropropyl)morpholine, 4-(3-Chloropropyl)morpholine, Morpholine, 4-(3-chloropropyl)-, NSC38889, NSC 38889, CID95834, NSC28831, LS-92661, STT-00318263

Molecular Formula: C7H14ClNOMolecular Weight: 163.645160 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: PIAZYBLGBSMNLX-UHFFFAOYSA-N

• 2-Hydroxy-6-Piocoline
IUPAC Name: 6-methyl-1H-pyridin-2-one | CAS Registry Number: 3279-76-3
Synonyms: 6-Methyl-2-pyridinol, 6-Methyl-2-pyridone, 2-Methyl-6-pyridone, 6-Hydroxy-2-picoline, 6-Methylpyridin-2-ol, 6-Methyl-2-pyridinone, 2-Pyridinol,6-methyl-, 2(1H)-Pyridone, 6-methyl-, 2-Hydroxy-6-methylpyridine, 6-Methyl-2-hydroxypyridine, NCIOpen2_000737, 6-methylpyridin-2(1H)-one, 128740_ALDRICH, NSC75619, 2(1H)-Pyridinone, 6-methyl-, 55768_FLUKA, CID76772, EINECS 221-919-5, NSC176166, SBB004345

Molecular Formula: C6H7NOMolecular Weight: 109.125880 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: JEAVIRYCMBDJIU-UHFFFAOYSA-N

• 2-Toluenesulfonyl Chloride
IUPAC Name: 2-methylbenzenesulfonyl chloride | CAS Registry Number: 133-59-5
Synonyms: o-Tosyl chloride, o-Toluenesulfonyl chloride, ortho-Toluenesulfochloride, ortho-Toluenesulfonchloride, 2-Methylbenzenesulfonyl chloride, Benzenesulfonyl chloride, 2-methyl-, O-TOLYLSULFONYL CHLORIDE, Toluene-2-sulphonyl chloride, ortho-Toluenesulfonyl chloride, 557323_ALDRICH, HSDB 5618, CID8623, NSC9354, o-Toluenesulfonyl chloride (8CI), ALBB-001003, ALD-N000058, NSC 9354, EINECS 205-113-0

Molecular Formula: C7H7ClO2SMolecular Weight: 190.647280 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: HDECRAPHCDXMIJ-UHFFFAOYSA-N

• (±)-2-Azabicyclo[2.2.1]hept-5-en-3-one
IUPAC Name: 3-azabicyclo[2.2.1]hept-5-en-2-one | CAS Registry Number: 49805-30-3
Synonyms: 2-Azabicyclo[2.2.1]hept-5-en-3-one, 4-Amino-2-cyclopentene-1-carboxylic acid lactam, (1S)-(+)-2-Azabicyclo[2.2.1]hept-5-en-3-one, 130931-83-8, ACMC-20a4cd, ACMC-1ASAH, (+/-)-2-Azabicyclo[2.2.1]hept-5-en-3-one, (1R,4S)-6-azabicyclo[2.2.1]hept-2-en-5-one, AC1LC6AD, (1S,4R)-2-Aza-bicyclo[2.2.1]hept-5-en-3-one, (1R)-(-)-2-Azabicyclo[2.2.1]hept-5-en-3-one, SureCN548616, KSC235O6L, AGN-PC-00G6X5, ( inverted exclamation markA)-2-Azabicyclo[2.2.1]hept-5-en-3-one, 331910_ALDRICH, 441279_ALDRICH, 441287_ALDRICH, BTBG00205, CTK1D5765

Molecular Formula: C6H7NOMolecular Weight: 109.125880 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: DDUFYKNOXPZZIW-UHFFFAOYSA-N

• 3-Furancarboxaldehyde
IUPAC Name: furan-3-carbaldehyde | CAS Registry Number: 498-60-2
Synonyms: 3-Furaldehyde, FURAN-3-ALDEHYDE, W501603_ALDRICH, 278866_ALDRICH, 47995_FLUKA, SBB004385, ZINC02040441, InChI=1/C5H4O2/c6-3-5-1-2-7-4-5/h1-4

Molecular Formula: C5H4O2Molecular Weight: 96.084060 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: AZVSIHIBYRHSLB-UHFFFAOYSA-N

• 9-Fluorenemethanol
IUPAC Name: 9H-fluoren-9-ylmethanol | CAS Registry Number: 24324-17-2
Synonyms: 9-Fluorenylmethanol, Fluorene-9-methanol, 9H-Fluorene-9-methanol, (Fluoren-9-yl)methanol, 9H-Fluoren-9-ylmethanol, 9-(Hydroxymethyl)fluorene, ChemDiv3_002715, 160504_ALDRICH, ZINC01004778, CID90466, EINECS 246-167-5, SBB008508, FR-2190, EU-0076483, F-2870, AN-512/13501009

Molecular Formula: C14H12OMolecular Weight: 196.244480 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: XXSCONYSQQLHTH-UHFFFAOYSA-N

• 4-Methoxybenzylamine
IUPAC Name: (4-methoxyphenyl)methanamine | CAS Registry Number: 2393-23-9
Synonyms: Anisylamine, Benzylamine der, p-Anisylamine, p-Methoxybenzylamine, Benzylamine, p-methoxy-, Benzenemethanamine, 4-methoxy-, Oprea1_248499, M11103_ALDRICH, 1-(4-methoxyphenyl)methanamine, Benzylamine, p-methoxy- (8CI), NSC9269, AIDS107188, AIDS-107188, NSC 9269, EINECS 219-247-2, 17061-61-9 (HYDROCHLORIDE), ST5213748, TL8001980, InChI=1/C8H11NO/c1-10-8-4-2-7(6-9)3-5-8/h2-5H,6,9H2,1H, PZM

Molecular Formula: C8H11NOMolecular Weight: 137.179040 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: IDPURXSQCKYKIJ-UHFFFAOYSA-N

• 3-Indolylacetonitrile
IUPAC Name: 2-(1H-indol-3-yl)acetonitrile | CAS Registry Number: 771-51-7
Synonyms: Indole-3-acetonitrile, 3-Indoleacetonitrile, Indoleacetonitrile, Indolylacetonitril, Indolylacetonitrile, 3-(Cyanomethyl)indole, Indol-3-ylacetonitrile, 3-Indolacetonitrile, 1H-Indole-3-acetonitrile, Acetonitrile, 3-indolyl-, INDOLEYL-CPD, (indol-3-yl)acetonitrile, USAF CB-29, indole-3-ylacetonitrile, (Indole-3-yl)acetonitrile, 1H-Indol-3-ylacetonitrile, (3-Indolyl)acetonitrile, CCRIS 5807, Indole-3-acetonitrile (8CI), WLN: T56 BMJ D1CN

Molecular Formula: C10H8N2Molecular Weight: 156.183920 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: DMCPFOBLJMLSNX-UHFFFAOYSA-N

• 1,3-Cycloheptanedione
IUPAC Name: cycloheptane-1,3-dione | CAS Registry Number: 1194-18-9
Synonyms: Cycloheptane-1,3-dione, SBB056238, ACMC-20aijy, PubChem20261, 1,3-Dioxocycloheptane;, cycloheptane-1,3-quinone, SureCN696582, 1 3-Cycloheptanedione 97, AC1N3Y6H, KSC173K8N, 515981_ALDRICH, CTK0H3586, MolPort-003-935-599, ACN-S002379, ANW-74972, ZINC00403358, AKOS015855290, AG-C-09648, AG-D-42341, LS40206

Molecular Formula: C7H10O2Molecular Weight: 126.153100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: DBOVMTXPZWVYAQ-UHFFFAOYSA-N

• 4-(4-Fluorophenyl)butyric acid
IUPAC Name: 5-(4-fluorophenyl)-5-oxopentanoic acid | CAS Registry Number: 149437-76-3
Synonyms: 4-(4-Fluorobenzoyl)butyric Acid, 5-(4-fluorophenyl)-5-oxopentanoic acid, 5-(4-Fluorophenyl)-5-oxovaleric Acid, 4-(4-Fluorobenzoyl)butyricacid, 4-fluorobenzoylbutyric acid, 4-(4-Fluorobenzoyl)butanoic acid, 4-fluorophenyl-5-oxopentanoic acid, 4-(4'-fluorobenzoyl) butyric acid, 4-(4-fluorobenzoyl)-1-butanoic acid, 4-fluoro-gamma-oxo-benzenepentanoic acid, 5-(4'-Fluorophenyl)-5-oxopentanoic acid, FBBA, AC1LENGO, PubChem13246, ACMC-209d2k, SureCN296337, p-Fluorobenzoylbutanoic acid, AC1Q75BX, Oprea1_166432, KSC489Q0D

Molecular Formula: C11H11FO3Molecular Weight: 210.201643 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: ZBQROUOOMAMCQW-UHFFFAOYSA-N

• 2-Nitrophenylhydrazine
IUPAC Name: (2-nitrophenyl)hydrazine | CAS Registry Number: 3034-19-3
Synonyms: o-NITROPHENYLHYDRAZINE, N21588_ALDRICH, Hydrazine, (2-nitrophenyl)-, HYDRAZINE, (o-NITROPHENYL)-, EINECS 221-222-6, BRN 0512797, ZINC03860653, LS-76925, 4-15-00-00304 (Beilstein Handbook Reference), T5501914, 6293-87-4, InChI=1/C6H7N3O2/c7-8-5-3-1-2-4-6(5)9(10)11/h1-4,8H,7H

Molecular Formula: C6H7N3O2Molecular Weight: 153.138680 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: FRBUNLLUASHNDJ-UHFFFAOYSA-N

• 2-Diethylaminoethanethiol Hydrochloride
IUPAC Name: 2-(diethylamino)ethanethiol hydrochloride | CAS Registry Number: 1942-52-5
Synonyms: USAF E-4, D86604_ALDRICH, Diethylaminoethanethiol hydrochloride, EINECS 217-731-8, CID16031, Diethyl-2-mercaptoethylammonium chloride, 2-Diethylaminoethanethiol hydrochloride, AI3-26086, LS-65910, 2-Diethylaminoethyl mercaptan hydrochloride, ETHANETHIOL, 2-(DIETHYLAMINO)-, HYDROCHLORIDE

Molecular Formula: C6H16ClNSMolecular Weight: 169.715940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: QAXLTZBBDSDRPW-UHFFFAOYSA-N


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