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Huili Chemical Co., Ltd.

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Contact: Li Yange - Sales Manager
Web: http://www.huilichemical.com
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Address: Shuangtang Town, Shanghai 221415, China
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Profile: Huili Chemical Co., Ltd. is a manufacturer of organic & inorganic compounds, active pharmaceutical ingredients and intermediates. Our products include L-2-bromophenylalanine, L(-)-malic acid, L-prolinamide, D-cycloserine, 4-nitro-3-trifluoromethyl aniline, 2-hydroxy-4-amino butanoic acid and 2-adamantanone. We also offer 6-hydroxy-1-tetralone, 5-methoxyisophthalic acid, 2,5-dibromo-3,4-dinitrothiophene, 2-methylpyrrolidine, 4-hydroxypyrimidine, 4-chloroacetyl-anisole and 2-indanone.

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• 2,3,6-Trifluorophenylboronic acid
IUPAC Name: (2,3,6-trifluorophenyl)boronic acid | CAS Registry Number: 247564-71-2
Synonyms: 524093_ALDRICH, T5532G1

Molecular Formula: C6H4BF3O2Molecular Weight: 175.900970 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: IWPDDRPLEKURGG-UHFFFAOYSA-N

• 2-(Methylsulfonyl)phenylboronic acid
IUPAC Name: (2-methylsulfonylphenyl)boronic acid | CAS Registry Number: 330804-03-0
Synonyms: 2-(Methanesulfonyl)phenylboronic acid, TL8002497

Molecular Formula: C7H9BO4SMolecular Weight: 200.019960 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: MSQFFCRGQPVQRS-UHFFFAOYSA-N

• 1-Hydroxyisoquinoline
IUPAC Name: 2H-isoquinolin-1-one | CAS Registry Number: 491-30-5
Synonyms: Isocarbostyril, 1-Isoquinolinol, Isoquinolin-1-one, isoquinolin-1-ol, 1(2H)-ISOQUINOLINONE, 1(2H)-Isoquinolone, Isoquinolin-1(2H)-one, ISOQUINOLIN-12H-ONE, Oprea1_201307, Isocarbostyril (VAN) (8CI), CHEBI:18350, CID10284, NSC27273, EINECS 207-732-1, NSC 27273, SBB004122, ZINC00332651, AI3-62131, ST5163468, C06324

Molecular Formula: C9H7NOMolecular Weight: 145.157980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: VDBNYAPERZTOOF-UHFFFAOYSA-N

• 8-Quinolinecarboxylic acid
IUPAC Name: quinoline-8-carboxylic acid | CAS Registry Number: 86-59-9
Synonyms: 8-Carboxyquinoline, Quinoline-8-carboxylic acid, CCRIS 6956, MLS000567372, 367796_ALDRICH, NSC6505, SMR000154120, LS-188094, ST5179417, H07026, AC-907/25014264

Molecular Formula: C10H7NO2Molecular Weight: 173.168080 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: QRDZFPUVLYEQTA-UHFFFAOYSA-N

• 3,4-Dimethoxyphenylboronic Acid
IUPAC Name: (3,4-dimethoxyphenyl)boronic acid | CAS Registry Number: 122775-35-3
Synonyms: 3,4-Dimethoxyphenylboronic acid, 480118_ALDRICH, (3,4-dimethoxyphenyl)boronic acid, ALBB-006117, FS011456, ST5405684, TL8000609

Molecular Formula: C8H11BO4Molecular Weight: 181.981540 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: RCVDPBFUMYUKPB-UHFFFAOYSA-N

• 1-Cyclopropyl-6,7-difluoro-8-methoxy-4-oxo-1,4-dihydroquinoline-3-carboxylic acid ethyl ester
IUPAC Name: ethyl 1-cyclopropyl-6,7-difluoro-8-methoxy-4-oxoquinoline-3-carboxylate | CAS Registry Number: 112811-71-9
Synonyms: 1-Cyclopropyl-6,7-difluoro-1,4-dihydro-8-methoxy-4-oxo-3-quinolinecarboxylic acid ethyl ester, ethyl 1-cyclopropyl-6,7-difluoro-8-methoxy-4-oxo-1,4-dihydroquinoline-3-carboxylate, 1-Cyclopropyl-6,7-difluoro-1,4-dihydro-8-methoxy-4-oxo-3-quinolinecarboxylicacidethylester, 1-cyclopropyl-6,7-difluoro-1,4-dihydro-8-methoxy-4-oxo-3-quinoline carboxylic acid ethyl ester, 1-Cyclopropyl-6,7-Difluoro-8-Methoxy-1,4-Dihydro-4-Oxo-3-Quinoline Carboxylic Acid Ethyl Ester, PubChem20717, ACMC-1C4ZE, SureCN1989474, Jsp000994, CTK0H4401, MolPort-003-847-565, ACT01933, AC-297, ANW-47398, SBB067143, ZINC02559584, AKOS005064002, AG-D-32255, RL00521, AK-40656

Molecular Formula: C16H15F2NO4Molecular Weight: 323.291406 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 7

InChIKey: XPAOPAPDCRLMTR-UHFFFAOYSA-N

• 2-Formylphenylboronic Acid
IUPAC Name: (2-formylphenyl)boronic acid | CAS Registry Number: 40138-16-7
Synonyms: 2-Formylphenylboronic acid, 2-Boronobenzaldehyde, 2-Formylbenzeneboronic acid, (2-formylphenyl)boronic acid, 2-(Dihydroxyboryl)benzaldehyde, 431958_ALDRICH, 47744_FLUKA, BM304, ALBB-006095, NSC157839, AC 35936, TL8002901

Molecular Formula: C7H7BO3Molecular Weight: 149.939680 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: DGUWACLYDSWXRZ-UHFFFAOYSA-N

• 3,5-Dimethylphenylboronic Acid
IUPAC Name: (3,5-dimethylphenyl)boronic acid | CAS Registry Number: 172975-69-8
Synonyms: 3,5-Dimethylphenylboronic acid, 480088_ALDRICH, SBB004076, D246, TL8001368

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

InChIKey: DJGHSJBYKIQHIK-UHFFFAOYSA-N

• 3-Chlorophenylboronic Acid
IUPAC Name: (3-chlorophenyl)boronic acid | CAS Registry Number: 63503-60-6
Synonyms: 3-Chlorophenylboronic acid, 3-chlorobenzeneboronic acid, (3-chlorophenyl)boronic acid, 3-chlorophenyl boronic acid, 3-chlorophenylbornic acid, (3-Chlorophenyl)Boranediol, 3-chloro benzene boronic acid, SBB048059, PubChem1785, m-chlorophenylboronic acid, SureCN11815, ACMC-209ng3, 3- Chlorophenylboronic acid, AC1MC0V2, 3-chloro-phenyl-boronic acid, KSC352Q2J, 417521_ALDRICH, AC1Q714J, CHEMBL164616, CTK2F2824

Molecular Formula: C6H6BClO2Molecular Weight: 156.374640 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: SDEAGACSNFSZCU-UHFFFAOYSA-N

• 4-Aminophenylboronic Acid pinacol ester
IUPAC Name: 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline | CAS Registry Number: 214360-73-3
Synonyms: nchembio.2007.34-comp17, 518751_ALDRICH, BM011, 4-Aminophenylboronic acid pinacol ester, ST5405624, 4-Aminophenylboronic acid, pinacol cyclic ester, 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)aniline, [4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]amine

Molecular Formula: C12H18BNO2Molecular Weight: 219.087820 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: ZANPJXNYBVVNSD-UHFFFAOYSA-N

• 4-Cyanophenylboronic Acid
IUPAC Name: (4-cyanophenyl)boronic acid | CAS Registry Number: 126747-14-6
Synonyms: 4-Cyanophenylboronic acid, Phenylboronic Acid, 10, 521418_ALDRICH, AC 35904, FS000034, TL8000670

Molecular Formula: C7H6BNO2Molecular Weight: 146.939040 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: CEBAHYWORUOILU-UHFFFAOYSA-N

• 4-Biphenylboronic Acid
IUPAC Name: (4-phenylphenyl)boronic acid | CAS Registry Number: 5122-94-1
Synonyms: 4-Biphenylboronic acid, Phenylboronic Acid, 11, biphenyl-4-ylboronic acid, 483451_ALDRICH, BM292, 1,1'-Biphenyl-4-yl-boronic acid, (1,1'-Biphenyl)-4-ylboronic acid, Boronic acid, (1,1'-biphenyl)-4-yl-, boronic acid, [1,1'-biphenyl]-4-yl-, TL806285, ST5407392, InChI=1/C12H11BO2/c14-13(15)12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9,14-15

Molecular Formula: C12H11BO2Molecular Weight: 198.025540 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: XPEIJWZLPWNNOK-UHFFFAOYSA-N

• 4-Pyridineboronic Acid
IUPAC Name: pyridin-4-ylboronic acid | CAS Registry Number: 1692-15-5
Synonyms: Pyridin-4-ylboronic acid, 4-Pyridineboronic acid, Pyridine-4-boronic acid, 634492_ALDRICH, ALBB-006123, SBB004280, FS000884, TL8001315

Molecular Formula: C5H6BNO2Molecular Weight: 122.917640 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: QLULGIRFKAWHOJ-UHFFFAOYSA-N

• 4-Bromoisoquinoline
IUPAC Name: 4-bromoisoquinoline | CAS Registry Number: 1532-97-4
Synonyms: Isoquinoline, 4-bromo-, B70202_ALDRICH, NSC56333, CID73743, EINECS 216-244-8, NSC 56333, ZINC00157206, AI3-61891, ST5308172, TL8001145, AC-907/25014358, InChI=1/C9H6BrN/c10-9-6-11-5-7-3-1-2-4-8(7)9/h1-6

Molecular Formula: C9H6BrNMolecular Weight: 208.054640 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: SCRBSGZBTHKAHU-UHFFFAOYSA-N

• (D)-Pipecolic acid
IUPAC Name: piperidine-2-carboxylic acid | CAS Registry Number: 1723-00-8
Synonyms: Pipecolic acid, Homoproline, Pipecolinic acid, pipecolate, Dihydrobaikiane, l-Pipecolic acid, L-pipecolate, Piperolinic acid, homopipecolic acid, Hexahydropicolinic acid, Pipecolic acid, L-, L-Pipecolinic acid, 2-PIPERIDINECARBOXYLIC ACID, DL-Pipecolinic acid, .alpha.-Pipecolinic acid, Acide pipecolique [French], Pipecolic acid free base, Pipecolic acid, L-(-)-, Pipecolic acid, (S)-(-)-, pipecolic acid, ion (1-)

Molecular Formula: C6H11NO2Molecular Weight: 129.157040 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: HXEACLLIILLPRG-UHFFFAOYSA-N

• 5-Bromonicotinic acid
IUPAC Name: 5-bromopyridine-3-carboxylic acid | CAS Registry Number: 20826-04-4
Synonyms: Nicotinic acid, 5-bromo-, 5-Bromo Nicotinic Acid, Maybridge3_006031, MLS000737908, TPC-PY044, 3-Pyridinecarboxylic acid, 5-bromo-, 5-Bromo-3-pyridinecarboxylic acid, 228435_ALDRICH, NSC 9461, EINECS 244-065-5, NSC9461, 5-Bromopyridine-3-carboxylic acid, BRN 0115854, SBB003524, IDI1_017418, LS-96532, SMR000528085, TL806116, 3-Pyridinecarboxylic acid, 5-bromo- (9CI), 5-22-02-00181 (Beilstein Handbook Reference)

Molecular Formula: C6H4BrNO2Molecular Weight: 202.005460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: FQIUCPGDKPXSLL-UHFFFAOYSA-N

• 2,3-Difluorophenylboronic acid
IUPAC Name: (2,3-difluorophenyl)boronic acid | CAS Registry Number: 121219-16-7
Synonyms: 514039_ALDRICH, BM415, AC 35912, TL8000564

Molecular Formula: C6H5BF2O2Molecular Weight: 157.910506 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: SZYXKFKWFYUOGZ-UHFFFAOYSA-N

• 4-Bromo-2-fluoropyridine
IUPAC Name: 4-bromo-2-fluoropyridine | CAS Registry Number: 128071-98-7
Synonyms: 2-Fluoro-4-bromopyridine, ZINC02526716, B2295G1, CID2762851, TL8000689, 3S100556

Molecular Formula: C5H3BrFNMolecular Weight: 175.986423 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: PTPTZLXZHPPVKG-UHFFFAOYSA-N

• 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehyde
IUPAC Name: 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehyde | CAS Registry Number: 128376-64-7
Synonyms: BM087, 4-Formylphenylboronic acid pinacol ester

Molecular Formula: C13H17BO3Molecular Weight: 232.083280 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: DMBMXJJGPXADPO-UHFFFAOYSA-N

• 5-Chloro-2,3,3-trimethylindole
IUPAC Name: 5-chloro-2,3,3-trimethylindole | CAS Registry Number: 25981-83-3
Synonyms: EINECS 247-387-4, CID117694, 5-Chloro-2,3,3-trimethyl-3H-indole, 3H-Indole, 5-chloro-2,3,3-trimethyl-, T-6630

Molecular Formula: C11H12ClNMolecular Weight: 193.672680 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: GSKATGIMEUGNJN-UHFFFAOYSA-N

• 3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
IUPAC Name: 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid | CAS Registry Number: 269409-73-6
Synonyms: 574694_ALDRICH, BM053, 3-Carboxyphenylboronic acid pinacol ester, ST5405619

Molecular Formula: C13H17BO4Molecular Weight: 248.082680 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: OPWAPCOSDAFWFB-UHFFFAOYSA-N

• 4-Ethylresorcinol
IUPAC Name: 4-ethylbenzene-1,3-diol | CAS Registry Number: 2896-60-8
Synonyms: 4-ETHYLRESORCINOL, 6-Ethylresorcinol, Resorcinol, 4-ethyl-, 4-Ethyl-resorcinol, 1,3-Benzenediol, 4-ethyl-, 2,4-Dihydroxy-1-ethylbenzene, 4-ethylbenzene-1,3-diol, 4-Ethyl-1,3-benzenediol, 1,3-Dihydroxy-4-ethylbenzene, E48200_ALDRICH, Resorcinol, 4-ethyl- (8CI), AIDS017767, AIDS-017767, NSC62013, EINECS 220-777-1, NSC 62013, ZINC00404411, ST5331805, TL8002287, InChI=1/C8H10O2/c1-2-6-3-4-7(9)5-8(6)10/h3-5,9-10H,2H2,1H

Molecular Formula: C8H10O2Molecular Weight: 138.163800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: VGMJYYDKPUPTID-UHFFFAOYSA-N

• 7-Fluoroindole
IUPAC Name: 7-fluoro-1H-indole | CAS Registry Number: 387-44-0
Synonyms: 7-fluoroindole, 7-fluoro-1H-indole, 1H-INDOLE, 7-FLUORO-, SBB054566, 7-Fluoroindole,, ZINC02572395, PubChem7294, AC1MCOJI, 7-fluoranyl-1H-indole, ACMC-209j1q, SureCN446638, KSC222E4R, Jsp006763, CTK1C2248, BUTTPARK 24\07-35, MolPort-000-155-596, ACT02485, ANW-28956, AKOS005063961, AC-1891

Molecular Formula: C8H6FNMolecular Weight: 135.138343 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: XONKJZDHGCMRRF-UHFFFAOYSA-N

• 5-Bromo-3-fluoropyridine
IUPAC Name: 3-bromo-5-fluoropyridine | CAS Registry Number: 407-20-5
Synonyms: 3-bromo-5-fluoropyridine, TPC-PY094, 646296_ALDRICH, ZINC00336455, CID820206, B192, ST5408685, TL8002959, AO-160/25072004

Molecular Formula: C5H3BrFNMolecular Weight: 175.986423 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: HNNNBQRRIHKFLI-UHFFFAOYSA-N

• 3,4-Dimethylphenylboronic acid
IUPAC Name: (3,4-dimethylphenyl)boronic acid | CAS Registry Number: 55499-43-9
Synonyms: (3,4-Dimethylphenyl)boronic acid, D2960G1, AC 35928, TL8003621

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

InChIKey: KDVZJKOYSOFXRV-UHFFFAOYSA-N

• 4-Pipecoline
IUPAC Name: 4-methylpiperidine | CAS Registry Number: 626-58-4
Synonyms: 4-Methylpiperidine, gamma-Pipecoline, Piperidine, 4-methyl-, .gamma.-Pipecoline, 4-Pipecoline (8CI), M73206_ALDRICH, NSC66495, EINECS 210-954-1, NSC 66495, AI3-52235, ST5213821, TL8004227, InChI=1/C6H13N/c1-6-2-4-7-5-3-6/h6-7H,2-5H2,1H

Molecular Formula: C6H13NMolecular Weight: 99.174120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: UZOFELREXGAFOI-UHFFFAOYSA-N

• 3-Thienyl isocyanate
IUPAC Name: 3-isocyanatothiophene | CAS Registry Number: 76536-95-3
Synonyms: 3-Thienyl Isocyanate, 3-isocyanatothiophene, SBB054892, AG-H-05517, ZINC00158759, thiophen-3-isocyanate, AC1MCQXE, Thiophene,3-isocyanato-, AC1Q6BOC, AC1Q6BOD, CTK5E3081, MolPort-000-142-473, AKOS000167121, AG-A-62770, RP00781, KB-33328, 3-Isocyanatothiophene;3-Thienyl isocyanate, FT-0616398, Y4030, A25718

Molecular Formula: C5H3NOSMolecular Weight: 125.148420 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: PVIZQOWWCLBJES-UHFFFAOYSA-N

• 1-N-Boc-3-Piperidone
IUPAC Name: tert-butyl 3-oxopiperidine-1-carboxylate | CAS Registry Number: 98977-36-7
Synonyms: 1-Boc-3-piperidone, 1-Boc-3-piperidinone, 650811_ALDRICH, ZINC04202422, ALBB-006250, CID2756825, tert-butyl 3-oxopiperidine-1-carboxylate, TL8006056

Molecular Formula: C10H17NO3Molecular Weight: 199.246880 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: RIFXIGDBUBXKEI-UHFFFAOYSA-N

• 3-Chloro-L-phenylalanine HCl
IUPAC Name: (2S)-2-amino-3-(3-chlorophenyl)propanoic acid | CAS Registry Number: 80126-51-8
Synonyms: 3-chloro-L-phenylalanine, L-3-Chlorophenylalanine, CHEBI:49597, AL026-1, TL8005403, (2S)-2-amino-3-(3-chlorophenyl)propanoic acid

Molecular Formula: C9H10ClNO2Molecular Weight: 199.634200 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: JJDJLFDGCUYZMN-QMMMGPOBSA-N

• 4-Hydroxy-3-Nitrobenzaldehyde
IUPAC Name: 4-hydroxy-3-nitrobenzaldehyde | CAS Registry Number: 3011-34-5
Synonyms: 4-Hydroxy-3-nitrobenzaldehyde, Benzaldehyde, 4-hydroxy-3-nitro-, 144320_ALDRICH, 4-FORMYL-2-NITROPHENOL, EINECS 221-141-6, NSC138267, SBB008631, NSC 138267, TL80073975, InChI=1/C7H5NO4/c9-4-5-1-2-7(10)6(3-5)8(11)12/h1-4,10

Molecular Formula: C7H5NO4Molecular Weight: 167.118900 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: YTHJCZRFJGXPTL-UHFFFAOYSA-N

• 3-Hydroxyphenylboronic Acid
IUPAC Name: (3-hydroxyphenyl)boronic acid | CAS Registry Number: 87199-18-6
Synonyms: 3-Hydroxyphenylboronic acid, 3-Hydroxybenzeneboronic acid, 523968_ALDRICH, H3740G1, AC 35941

Molecular Formula: C6H7BO3Molecular Weight: 137.928980 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: WFWQWTPAPNEOFE-UHFFFAOYSA-N

• 1,1'-bis(diphenylphosphino)ferrocene
IUPAC Name: cyclopenta-2,4-dien-1-yl(diphenyl)phosphane; iron | CAS Registry Number: 12150-46-8
Synonyms: NSC238923

Molecular Formula: C34H20FeP2-10Molecular Weight: 546.315122 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 10

InChIKey: KNVAAITVNCIMBM-UHFFFAOYSA-N

• 2-Bromothiazole
IUPAC Name: 2-bromo-1,3-thiazole | CAS Registry Number: 3034-53-5
Synonyms: Thiazole, 2-bromo-, 2-Bromo-1,3-thiazole, 160474_ALDRICH, NSC91532, EINECS 221-229-4, NSC 91532, SBB003918, ZINC01592420, B2607G25, TL806302, InChI=1/C3H2BrNS/c4-3-5-1-2-6-3/h1-2

Molecular Formula: C3H2BrNSMolecular Weight: 164.023680 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: RXNZFHIEDZEUQM-UHFFFAOYSA-N

• 4-Aminopyrimidine-5-Carboxylic Acid
IUPAC Name: 4-aminopyrimidine-5-carboxylic acid | CAS Registry Number: 20737-41-1
Synonyms: 4-Aminopyrimidine-5-carboxylic acid, 4-amino-pyrimidine-5-carboxylic acid, 4-amino-5-pyrimidinecarboxylic acid, 4-aminopyrimidine-5-carboxylicacid, 5-pyrimidinecarboxylic acid, 4-amino-, AG-E-52110, PubChem21834, ACMC-209fdo, SureCN758324, Oprea1_762663, AC-907/25014069, CTK4E4979, MolPort-000-151-226, BB_NC-2406, HMS1787L22, 4-AMINO-5-CARBOXYPYRIMIDINE, ACT01611, ANW-24202, SBB014257, STK661734

Molecular Formula: C5H5N3O2Molecular Weight: 139.112100 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: ZUBDZQFROMAIPT-UHFFFAOYSA-N

• 1H-Imidazole-4-carboxylic acid
IUPAC Name: 1H-imidazole-5-carboxylic acid | CAS Registry Number: 1072-84-0
Synonyms: 4-Carboxyimidazole, 5-Imidazolic acid, 4-Imidazolecarboxylic acid, IMIDAZOLE-4-CARBOXYLIC ACID, 425842_ALDRICH, 1H-Imidazole-5-carboxylic acid, EINECS 214-017-8, TOS-BB-0098, TULIP028428, NSC 32340, CID14080, NSC32340, SBB004323, EC-000.1277, LS-78202, TL8000256

Molecular Formula: C4H4N2O2Molecular Weight: 112.086760 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: NKWCGTOZTHZDHB-UHFFFAOYSA-N

• 4-Bromo-2,8-bis(trifluoromethyl)quinoline
IUPAC Name: 4-bromo-2,8-bis(trifluoromethyl)quinoline | CAS Registry Number: 35853-45-3
Synonyms: CC-PMLSC-DMA-P108, 346098_ALDRICH, QU177, CID4071242, 2,8-Bis(trifluoromethyl)-4-bromoquinoline, TL8002658

Molecular Formula: C11H4BrF6NMolecular Weight: 344.050579 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 7

InChIKey: DXALAFAFIXJDOS-UHFFFAOYSA-N

• 2,5-Dibromo-3,4-Dinitrothiophene
IUPAC Name: 2,5-dibromo-3,4-dinitrothiophene | CAS Registry Number: 52431-30-8
Synonyms: NCIOpen2_009291, NSC84661, 2,5-Dibromo-3,4-dinitrothiophene, CID257024, NSC145788, ZINC04897595, Thiophene, 2,5-dibromo-3,4-dinitro-, ST5411268

Molecular Formula: C4Br2N2O4SMolecular Weight: 331.926800 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: AHGHPBPARMANQD-UHFFFAOYSA-N

• 4-(4-Bromo-2-Fluoroanilino)-6-Methoxy-7-[(1-Methylpiperidin-4-Yl)methoxy]quinazoline
IUPAC Name: N-(4-bromo-2-fluorophenyl)-6-methoxy-7-[(1-methylpiperidin-4-yl)methoxy]quinazolin-4-amine | CAS Registry Number: 443913-73-3
Synonyms: Vandetanib, Zactima, vande-tanib, 2ivu, Vandetanib [INN], Vandetanib (JAN/INN), ZD6474, UNII-YO460OQ37K, CHEBI:49960, ZD 6474, ZD-6474, AZD-6474, CID3081361, NCGC00167513-01, LS-184394, D06407, C452423, N-(4-Bromo-2-fluorophenyl)-6-methoxy-7-((1-methyl-4-piperidinyl)methoxy)-4-quinazolinamine, N-(4-Bromo-2-fluorophenyl)-6-methoxy-7-((1-methylpiperidin-4-yl)methoxy)quinazolin-4-amine, 4-Quninazolinamine, N-(4-bromo-2-fluorophenyl)-6-methoxy-7-((1-methyl-4-piperidinyl)methoxy)-

Molecular Formula: C22H24BrFN4O2Molecular Weight: 475.353963 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 7

InChIKey: UHTHHESEBZOYNR-UHFFFAOYSA-N

• 2-Nitroimidazole
IUPAC Name: 2-nitro-1H-imidazole | CAS Registry Number: 527-73-1
Synonyms: Azomycin, Amicin, Imidazole, 2-nitro-, 1H-Imidazole, 2-nitro-, NITRO-1H-IMIDAZOLE, 2-NITRO-1H-IMIDAZOLE, WLN: T5M CNJ BNW, 195650_ALDRICH, C3H3N3O2, EINECS 208-425-5, NSC105831, Ro 05-9129, AIDS059761, NSC 105831, AIDS-059761, BRN 0116444, ZINC01481980, LS-78837, Ro-59129-001, C14531

Molecular Formula: C3H3N3O2Molecular Weight: 113.074820 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: YZEUHQHUFTYLPH-UHFFFAOYSA-N

• 5-Hydroxymethyl Thiazole
IUPAC Name: 1,3-thiazol-5-ylmethanol | CAS Registry Number: 38585-74-9
Synonyms: 5-Thiazolemethanol, 5-Hydroxymethylthiazole, Ambap2763, ZINC02527712, CID2763216, T2166M500, TL8002812

Molecular Formula: C4H5NOSMolecular Weight: 115.153600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: WKBQQWDVVHGWDB-UHFFFAOYSA-N

• 3- Methylphenylboronic Acid
IUPAC Name: (3-methylphenyl)boronic acid | CAS Registry Number: 17933-03-8
Synonyms: m-Tolylboronic acid, 3-Methylphenylboronic acid, Ambap1988, (3-Methylphenyl)boronic acid, 393614_ALDRICH, BM044, ALBB-006091, LS-45154, TL8001432

Molecular Formula: C7H9BO2Molecular Weight: 135.956160 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: BJQCPCFFYBKRLM-UHFFFAOYSA-N

• 3-(Trifluoromethyl)phenylboronic Acid
IUPAC Name: [3-(trifluoromethyl)phenyl]boronic acid | CAS Registry Number: 1423-26-3
Synonyms: Phenylboronic Acid, 3, 432032_ALDRICH, 3-(Trifluoromethyl)phenylboronic acid, 3-Trifluoromethylphenylboronic acid, BM136, 3-(Trifluoromethyl)benzeneboronic acid, ST5405981, TL8000936

Molecular Formula: C7H6BF3O2Molecular Weight: 189.927550 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: WOAORAPRPVIATR-UHFFFAOYSA-N

• 4-Hydroxymethylphenylboronic Acid
IUPAC Name: [4-(hydroxymethyl)phenyl]boronic acid | CAS Registry Number: 59016-93-2
Synonyms: Ambap2478, 512338_ALDRICH, 4-(Hydroxymethyl)phenylboronic acid, 4-Hydroxymethyl phenyl boronic acid, FS011452, TL806277

Molecular Formula: C7H9BO3Molecular Weight: 151.955560 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: PZRPBPMLSSNFOM-UHFFFAOYSA-N

• 5-Fluoro-2-methylphenylboronic Acid
IUPAC Name: (5-fluoro-2-methylphenyl)boronic acid | CAS Registry Number: 163517-62-2
Synonyms: 567442_ALDRICH, 5-Fluoro-2-methylphenylboronic acid, 2-Methyl-5-fluorophenylboronic acid, F3332G1, TL8001249

Molecular Formula: C7H8BFO2Molecular Weight: 153.946623 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: QKOJLMKWBRBZNQ-UHFFFAOYSA-N

• 6-Hydroxy-2-naphthaldehyde
IUPAC Name: 6-hydroxynaphthalene-2-carbaldehyde | CAS Registry Number: 78119-82-1
Synonyms: ZINC02585500, CID2764110, 5Y-5022

Molecular Formula: C11H8O2Molecular Weight: 172.180020 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: PRYNJOJHKYNLIS-UHFFFAOYSA-N

• 4-Methyl-5-thiazolecarboxaldehyde
IUPAC Name: 4-methyl-1,3-thiazole-5-carbaldehyde | CAS Registry Number: 82294-70-0
Synonyms: 4-Methyl-5-formylthiazole, 5-Formyl-4-methylthiazole, 633208_ALDRICH, 4-Methylthiazole-5-carboxaldehyde, 4-Methyl-1,3-thiazole-5-carbaldehyde, ALBB-006041, TL8005444, InChI=1/C5H5NOS/c1-4-5(2-7)8-3-6-4/h2-3H,1H

Molecular Formula: C5H5NOSMolecular Weight: 127.164300 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: JJVIEMFQPALZOZ-UHFFFAOYSA-N

• (L)-Pipecolic acid
IUPAC Name: piperidine-2-carboxylic acid | CAS Registry Number: 3105-95-1
Synonyms: Pipecolic acid, Homoproline, Pipecolinic acid, pipecolate, Dihydrobaikiane, l-Pipecolic acid, L-pipecolate, Piperolinic acid, homopipecolic acid, Hexahydropicolinic acid, Pipecolic acid, L-, L-Pipecolinic acid, 2-PIPERIDINECARBOXYLIC ACID, DL-Pipecolinic acid, .alpha.-Pipecolinic acid, Acide pipecolique [French], Pipecolic acid free base, Pipecolic acid, L-(-)-, Pipecolic acid, (S)-(-)-, pipecolic acid, ion (1-)

Molecular Formula: C6H11NO2Molecular Weight: 129.157040 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: HXEACLLIILLPRG-UHFFFAOYSA-N

• 2-Amino-6-fluorobenzothiazole
IUPAC Name: 6-fluoro-1,3-benzothiazol-2-amine | CAS Registry Number: 348-40-3
Synonyms: Maybridge1_006546, Oprea1_016706, Oprea1_694425, MLS001005445, 324213_ALDRICH, 2-Benzothiazolamine, 6-fluoro-, NSC266095, ZINC00035872, SDCCGMLS-0066208.P001, SMR000383987, TL8002587, A2651/0112961, InChI=1/C7H5FN2S/c8-4-1-2-5-6(3-4)11-7(9)10-5/h1-3H,(H2,9,10

Molecular Formula: C7H5FN2SMolecular Weight: 168.191403 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: CJLUXPZQUXVJNF-UHFFFAOYSA-N

• 8-Chloroquinoline
IUPAC Name: 8-chloroquinoline | CAS Registry Number: 611-33-6
Synonyms: Quinoline, 8-chloro-, CCRIS 3982, CHEBI:48985, EINECS 210-265-6, NSC 56815, NSC56815, ZINC01687638, LS-141717, ST5405519

Molecular Formula: C9H6ClNMolecular Weight: 163.603640 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: RUSMDMDNFUYZTM-UHFFFAOYSA-N

• 6-Chloroquinoline
IUPAC Name: 6-chloroquinoline | CAS Registry Number: 612-57-7
Synonyms: Quinoline, 6-chloro-, CCRIS 3981, NSC4682, 375098_ALDRICH, NSC 4682, EINECS 210-314-1, CID69163, ZINC00066127, LS-188173, ST5405278, InChI=1/C9H6ClN/c10-8-3-4-9-7(6-8)2-1-5-11-9/h1-6

Molecular Formula: C9H6ClNMolecular Weight: 163.603640 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: GKJSZXGYFJBYRQ-UHFFFAOYSA-N


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