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Catalogue Products

ID	Product Name	CAS NO
EN000017	2-propylbenzene-1,3-diol	13331-19-6
EN000025	3-methoxy-4-nitrophenol	16292-95-8
EN000041	1-bromo-4-(difluoromethoxy)Benzene	5905-69-1
EN000055	methyl 3-cyano-4-hydroxybenzoate	156001-68-2
EN000058	4-(Difluoromethoxy)phenylboronic acid pinacol ester	887757-48-4
EN000063	4-ethoxy-5-isopropyl-2-methylbenzaldehyde	872183-70-5
EN000083	1-(3-chlorophenyl)acetone	14123-60-5
EN000088	2-(4-fluorophenoxy)ethanamine	6096-89-5
EN000094	1-(5-bromo-2-fluorophenyl)ethanone	198477-89-3

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• 4,6-Dichloro-5-nitropyrimidine

IUPAC Name: 4,6-dichloro-5-nitropyrimidine | CAS Registry Number: 4316-93-2
Synonyms: 4,6-Dichloro-5-nitro-pyridine, D69300_ALDRICH, 36080_FLUKA, EINECS 224-340-6, NSC 89693, PYRIMIDINE, 4,6-DICHLORO-5-NITRO-, NSC89693, BRN 0162029, SBB010041, ZINC01078933, LS-135059, TL8003042, 4-23-00-00899 (Beilstein Handbook Reference)

Molecular Formula:	C₄HCl₂N₃O₂	Molecular Weight:	193.975640 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: HCTISZQLTGAYOX-UHFFFAOYSA-N

• 4-Amino-2-Chloropyrimidine

IUPAC Name: 2-chloropyrimidin-4-amine | CAS Registry Number: 7461-50-9
Synonyms: Ambap6218, 2-Chloro-4-pyrimidinamine, 2-Chloro-4-aminopyrimidine, 4-Amino-2-chloropyrimidine, 2-chloropyrimidin-4-ylamine, NSC403512, CID345752, ZINC01595944, TL8005132, AC-907/30002015

Molecular Formula:	C₄H₄ClN₃	Molecular Weight:	129.547660 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: LPBDZVNGCNTELM-UHFFFAOYSA-N

• 4-Hydroxypyrimidine

IUPAC Name: 1H-pyrimidin-6-one | CAS Registry Number: 4562-27-0
Synonyms: 4-Pyrimidinol, Deaminoisocytosine, 4-Oxopyrimidine, pyrimidin-4-ol, 4-Oxypyrimidine, 4-Pyrimidinone, 4-Pyrimidone, 6-Hydroxypyrimidine, 4(3H)-Pyrimidone, 1H-Pyrimidin-4-one, 4(1H)-PYRIMIDINONE, 4(3H)-Pyrimidinone, 4-Pyrimidinol (VAN), Ambap868, 3H-Pyrimidin-4-one, 4(6)-Hydroxypyrimidine, Pyrimidine, 4-hydroxy-, 858064_ALDRICH, NSC 1575, 56420_FLUKA

Molecular Formula:	C₄H₄N₂O	Molecular Weight:	96.087360 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: DNCYBUMDUBHIJZ-UHFFFAOYSA-N

• 5-Bromo-2,4-dichloropyrimidine

IUPAC Name: 5-bromo-2,4-dichloropyrimidine | CAS Registry Number: 36082-50-5
Synonyms: 416762_ALDRICH, 5-Bromo-2,4-dichloro-pyrimidine, CID289973, NSC152517, SBB003301, ZINC01559999, TL8002671, AF-399/25108039

Molecular Formula:	C₄HBrCl₂N₂	Molecular Weight:	227.874140 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: SIKXIUWKPGWBBF-UHFFFAOYSA-N

• 5-Bromo-2-chloropyrimidine

IUPAC Name: 5-bromo-2-chloropyrimidine | CAS Registry Number: 32779-36-5
Synonyms: Ambap6262, 2-Chloro-5-bromopyrimidine, 596949_ALDRICH, 47149_FLUKA, ALBB-006331, ZINC01529074, B2217G5, TL8002470, AA-516/30054033

Molecular Formula:	C₄H₂BrClN₂	Molecular Weight:	193.429080 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: XPGIBDJXEVAVTO-UHFFFAOYSA-N

• 5-bromo-2methoxypyrimidine

IUPAC Name: 5-bromo-2-methoxypyrimidine | CAS Registry Number: 14001-66-2
Synonyms: 5-Bromo-2-methoxypyrimidine, 634883_ALDRICH, Pyrimidine,5-bromo-2-methoxy-, Pyrimidine, 5-bromo-2-methoxy-, ZINC02540622, CID139657, B2218G1, TL80073571

Molecular Formula:	C₅H₅BrN₂O	Molecular Weight:	189.010000 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: DWVCZDMMGYIULX-UHFFFAOYSA-N

• 5-Methyl-pyrimidine

IUPAC Name: 5-methylpyrimidine | CAS Registry Number: 2036-41-1
Synonyms: 5-Methylpyrimidine, Pyrimidine, 5-methyl-, ZINC01852614, CID74859, EINECS 218-006-9, TL8007071

Molecular Formula:	C₅H₆N₂	Molecular Weight:	94.114540 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: TWGNOYAGHYUFFR-UHFFFAOYSA-N

• 5-Nitro-6-methyluracil

IUPAC Name: 6-methyl-5-nitro-1H-pyrimidine-2,4-dione | CAS Registry Number: 16632-21-6
Synonyms: 6-Methyl-5-nitrouracil, 4-Methyl-5-nitrouracil, Maybridge1_006298, Uracil, 6-methyl-5-nitro-, D8378_SIGMA, AIDS046395, AIDS-046395, NSC40201, EINECS 240-688-1, STK294123, ZINC03898526, 2,4-Dihydroxy-6-methyl-5-nitropyrimidine, 5-nitro-6-methyl-2,4-pyrimidinediol, ST5409433, EU-0000846, 2,4(1H,3H)-Pyrimidinedione, 6-methyl-5-nitro-, AC-907/30003030

Molecular Formula:	C₅H₅N₃O₄	Molecular Weight:	171.110900 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: LIVYMRJSNFHYEN-UHFFFAOYSA-N

• 3-mercaptobenzoic acid

IUPAC Name: 3-sulfanylbenzoic acid | CAS Registry Number: 4869-59-4
Synonyms: 3-Mercaptobenzoic acid, Benzoic acid, 3-mercapto-, 451436_ALDRICH, NSC32021, CID95737, NSC 32021, NA-0707, TL8006772

Molecular Formula:	C₇H₆O₂S	Molecular Weight:	154.186340 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: RSFDFESMVAIVKO-UHFFFAOYSA-N

• 2-Chloropyridine-4-boronic Acid

IUPAC Name: (2-chloropyridin-4-yl)boronic acid | CAS Registry Number: 458532-96-2
Synonyms: 2-Chloropyridine-4-boronic acid, 666513_ALDRICH, FS000014

Molecular Formula:	C₅H₅BClNO₂	Molecular Weight:	157.362700 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: WJYRVVDXJMJLTN-UHFFFAOYSA-N

• 2-Fluoro-4-methoxyphenylboronic Acid

IUPAC Name: (2-fluoro-4-methoxyphenyl)boronic acid | CAS Registry Number: 162101-31-7
Synonyms: 2-Fluoro-4-methoxyphenylboronic acid, TE4184, ST5408266

Molecular Formula:	C₇H₈BFO₃	Molecular Weight:	169.946023 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: ULUIXJDBPYBAHS-UHFFFAOYSA-N

• 2-Methoxyphenylboronic Acid

IUPAC Name: (2-methoxyphenyl)boronic acid | CAS Registry Number: 5720-06-9
Synonyms: Ambap3798, 2-Methoxyphenylboronic acid, Phenylboronic Acid, 17, o-Methoxyphenylboronic acid, 2-Methoxybenzeneboronic acid, 445231_ALDRICH, BM299, TL8003682

Molecular Formula:	C₇H₉BO₃	Molecular Weight:	151.955560 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: ROEQGIFOWRQYHD-UHFFFAOYSA-N

• 2-Methoxy-5-pyrimidineboronic Acid

IUPAC Name: (2-methoxypyrimidin-5-yl)boronic acid | CAS Registry Number: 628692-15-9
Synonyms: BM591, 2-Methoxy-5-pyrimidineboronic acid, 2-Methoxypyrimidine-5-boronic acid, TL8004295

Molecular Formula:	C₅H₇BN₂O₃	Molecular Weight:	153.931680 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	5

InChIKey: YPWAJLGHACDYQS-UHFFFAOYSA-N

• 2-Methoxypyridine-5-boronic Acid

IUPAC Name: (6-methoxypyridin-3-yl)boronic acid | CAS Registry Number: 163105-89-3
Synonyms: 637610_ALDRICH, 2-Methoxy-5-pyridineboronic acid, 2-Methoxypyridine-5-boronic acid, BM133, MO 01245

Molecular Formula:	C₆H₈BNO₃	Molecular Weight:	152.943620 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: DHADXDMPEUWEAS-UHFFFAOYSA-N

• 3-Carboxyphenylboronic Acid

IUPAC Name: 3-boronobenzoic acid | CAS Registry Number: 25487-66-5
Synonyms: 3-Boronobenzoic acid, 3-Carboxyphenylboronic acid, 456764_ALDRICH, ALBB-006101, FS000841, ST5405809, TL8002069

Molecular Formula:	C₇H₇BO₄	Molecular Weight:	165.939080 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	4

InChIKey: DBVFWZMQJQMJCB-UHFFFAOYSA-N

• 3-Formylphenylboronic Acid

IUPAC Name: (3-formylphenyl)boronic acid | CAS Registry Number: 87199-16-4
Synonyms: 3-Formylphenylboronic acid, 3-Boronobenzaldehyde, (3-formylphenyl)boronic acid, 3-(Dihydroxyboryl)benzaldehyde, 441651_ALDRICH, 47746_FLUKA, BM108, ALBB-006128, SBB004078, CID2734356, TL8005660, AF-399/25108027

Molecular Formula:	C₇H₇BO₃	Molecular Weight:	149.939680 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: HJBGZJMKTOMQRR-UHFFFAOYSA-N

• 3-Methoxycarbonylphenylboronic Acid

IUPAC Name: (3-methoxycarbonylphenyl)boronic acid | CAS Registry Number: 99769-19-4
Synonyms: Methyl 3-boronobenzoate, 3-Methoxycarbonylphenylboronic acid, 591130_ALDRICH, BM092, ALBB-006126, (3-methoxycarbonylphenyl)boronic acid, 3-(Methoxycarbonyl)phenylboronic acid, TL806294, ST5405682

Molecular Formula:	C₈H₉BO₄	Molecular Weight:	179.965660 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: ALTLCJHSJMGSLT-UHFFFAOYSA-N

• 3-Nitropenylboronic Acid

IUPAC Name: (3-nitrophenyl)boronic acid | CAS Registry Number: 13331-27-6
Synonyms: 3-nitrophenylboronic acid, 3-Nitrobenzeneboronic acid, m-Nitrophenylboronic acid, m-Nitrobenzeneboronic acid, Benzeneboronic acid, m-nitro-, Ambap4631, WLN: WNR CBQQ, (3-nitrophenyl)boronic acid, Boronic acid, (3-nitrophenyl)-, 325104_ALDRICH, NSC 59739, BM115, ALBB-006120, NSC59739, BRN 2938638, NSC401539, AI3-60393, DB02797, NCGC00092010-01, LS-29188

Molecular Formula:	C₆H₆BNO₄	Molecular Weight:	166.927140 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: ZNRGSYUVFVNSAW-UHFFFAOYSA-N

• 3-Pyridineboronic Acid

IUPAC Name: pyridin-3-ylboronic acid | CAS Registry Number: 1692-25-7
Synonyms: Pyridine-3-boronic acid, 3-Pyridineboronic acid, 3-pyridinylboronic acid, pyridin-3-ylboronic acid, 512125_ALDRICH, BM101, ALBB-006011, CC 04112, TL8001316

Molecular Formula:	C₅H₆BNO₂	Molecular Weight:	122.917640 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: ABMYEXAYWZJVOV-UHFFFAOYSA-N

• 4-(Trifluoromethoxy)phenylboronic Acid

IUPAC Name: [4-(trifluoromethoxy)phenyl]boronic acid | CAS Registry Number: 139301-27-2
Synonyms: 510130_ALDRICH, BM250, 4-(Trifluoromethoxy)phenylboronic acid, 4-Trifluoromethoxyphenylboronic acid, ST5405983, TL8000894

Molecular Formula:	C₇H₆BF₃O₃	Molecular Weight:	205.926950 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	6

InChIKey: HUOFUOCSQCYFPW-UHFFFAOYSA-N

• 4-Carboxyphenylboronic Acid

IUPAC Name: 4-boronobenzoic acid | CAS Registry Number: 14047-29-1
Synonyms: 4-Boronobenzoic acid, 4-Carboxyphenylboronic acid, WLN: VHOR DBQQ, Benzoic acid, p-borono-, Benzoic acid, 4-borono-, p-Carboxyphenylboronic acid, 4-(Dihydroxyboryl)benzoic acid, 456772_ALDRICH, Benzeneboronic acid, p-carboxy-, BM052, ALBB-006102, NSC221170, SBB003899, DB03140, NCGC00092012-01, TL8000905, AF-399/25108028, 4CB

Molecular Formula:	C₇H₇BO₄	Molecular Weight:	165.939080 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	4

InChIKey: SIAVMDKGVRXFAX-UHFFFAOYSA-N

• 4-Chloro-2-(trifluoromethyl)phenylboronic Acid

IUPAC Name: [4-chloro-2-(trifluoromethyl)phenyl]boronic acid | CAS Registry Number: 313545-41-4
Synonyms: 4-Chloro-2-(trifluoromethyl)phenylboronic acid, 4-Chloro-2-trifluoromethylphenylboronic acid, 4-Chloro-2-(trifluoromethyl)benzeneboronic acid, SBB052528, AG-F-04363, 2-Chloro-4-trifluoromethyl- phenylboronic acid, PubChem5158, ACMC-20aic7, AC1MC80E, SureCN2313879, [4-chloro-2-(trifluoromethyl)phenyl]boronic Acid, KSC566S3F, Jsp005853, CTK4G6932, 2-Borono-5-chlorobenzotrifluoride, MolPort-000-139-423, BM601, ACN-S004008, ANW-74693, AKOS004113745

Molecular Formula:	C₇H₅BClF₃O₂	Molecular Weight:	224.372610 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	5

InChIKey: YAPBOBGBYQQYHX-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:	C₇H₆BNO₂	Molecular Weight:	146.939040 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: CEBAHYWORUOILU-UHFFFAOYSA-N

• 4-Formylphenylboronic Acid

IUPAC Name: (4-formylphenyl)boronic acid | CAS Registry Number: 87199-17-5
Synonyms: 4-Formylphenylboronic acid, 4-Boronobenzaldehyde, 4-Formylbenzeneboronic acid, (4-formylphenyl)boronic acid, 4-(Dihydroxyboryl)benzaldehyde, 431966_ALDRICH, Boronic acid, (4-formylphenyl)-, BM110, ALBB-006114, SBB004077, NCGC00092013-01, TL8005661, AF-399/25108026

Molecular Formula:	C₇H₇BO₃	Molecular Weight:	149.939680 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: VXWBQOJISHAKKM-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:	C₇H₉BO₃	Molecular Weight:	151.955560 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	3

InChIKey: PZRPBPMLSSNFOM-UHFFFAOYSA-N

• 4-N-Pentylphenylboronic Acid

IUPAC Name: (4-pentylphenyl)boronic acid | CAS Registry Number: 121219-12-3
Synonyms: 4-n-Pentylphenylboronic acid, ST5408356, TL8000563

Molecular Formula:	C₁₁H₁₇BO₂	Molecular Weight:	192.062480 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: UZRMPSOGFATLJE-UHFFFAOYSA-N

• 4-Tert-Butylphenylboronic Acid

IUPAC Name: (4-tert-butylphenyl)boronic acid | CAS Registry Number: 123324-71-0
Synonyms: 4-tert-Butylphenylboronic acid, 480053_ALDRICH, BM260, ST5405957, TL8000625

Molecular Formula:	C₁₀H₁₅BO₂	Molecular Weight:	178.035900 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: MNJYZNVROSZZQC-UHFFFAOYSA-N

• 2-Amino-5-bromothiazole hydrobromide

IUPAC Name: 5-bromo-1,3-thiazol-2-amine hydrobromide | CAS Registry Number: 61296-22-8
Synonyms: 128023_ALDRICH, 2-Amino-5-bromothiazole monohydrobromide, NSC508984, D2473G5, TL806145, 2-THIAZOLAMINE, 5-BROMO-, MONOHYDROBROMIDE, T5290763

Molecular Formula:	C₃H₄Br₂N₂S	Molecular Weight:	259.950260 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: NUSVDASTCPBUIP-UHFFFAOYSA-N

• 3-Hydroxy-1-Methylpyrrolidine

IUPAC Name: 1-methylpyrrolidin-3-ol | CAS Registry Number: 13220-33-2
Synonyms: 1-Methyl-3-pyrrolidinol, N-Methyl-3-pyrrolidinol, 1-Methylpyrrolidin-3-ol, M79506_ALDRICH, ARK081, NSC89279, EINECS 236-189-3, NSC 89279, TL8000765

Molecular Formula:	C₅H₁₁NO	Molecular Weight:	101.146940 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: FLVFPAIGVBQGET-UHFFFAOYSA-N

• 2-(2-Aminoethyl)-2-methylpyrrolldine

IUPAC Name: 2-(1-methylpyrrolidin-2-yl)ethanamine | CAS Registry Number: 51387-90-7
Synonyms: 139505_ALDRICH, 2-(2-Aminoethyl)-1-methylpyrrolidine, 1-Methylpyrrolidine-2-ethylamine, 2-Pyrrolidineethanamine, 1-methyl-, EINECS 257-169-0, NSC118052

Molecular Formula:	C₇H₁₆N₂	Molecular Weight:	128.215340 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: PNHGJPJOMCXSKN-UHFFFAOYSA-N

• 2,4-difluorobenzoic acid

IUPAC Name: 2,4-difluorobenzoic acid | CAS Registry Number: 1583-58-0
Synonyms: 2,4-Difluorobenzoic acid, Ambap1792, 2,4-Difluoro-benzoic acid, Benzoic acid, 2,4-difluoro-, 2,4-DIFLUOROBENZOATE, 264296_ALDRICH, NSC10312, CID74102, JRD-0116, EINECS 216-430-9, TL806420, InChI=1/C7H4F2O2/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3H,(H,10,11

Molecular Formula:	C₇H₄F₂O₂	Molecular Weight:	158.102266 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: NJYBIFYEWYWYAN-UHFFFAOYSA-N

• 2-Fluoro-4-Nitrobenzoic acid

IUPAC Name: 2-fluoro-4-nitrobenzoic acid | CAS Registry Number: 403-24-7
Synonyms: NSC190361, CID302679, ST5408285

Molecular Formula:	C₇H₄FNO₄	Molecular Weight:	185.109363 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	5

InChIKey: MMWFMFZFCKADEL-UHFFFAOYSA-N

• 2-amino-4-fluorobenzoic acid

IUPAC Name: 2-amino-4-fluorobenzoic acid | CAS Registry Number: 446-32-2
Synonyms: 4-Fluoroanthranilic acid, 2-Amino-4-fluorobenzoic acid, 370169_ALDRICH, 07972_FLUKA, EINECS 207-163-9, SBB006590, A197, TL8003119, A-5520, 3S104455, InChI=1/C7H6FNO2/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3H,9H2,(H,10,11

Molecular Formula:	C₇H₆FNO₂	Molecular Weight:	155.126443 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: LGPVTNAJFDUWLF-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:	C₇H₄BrClO₂	Molecular Weight:	235.462460 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: JAVZWSOFJKYSDY-UHFFFAOYSA-N

• 2,5-Dibromobenzoic Acid

IUPAC Name: 2,5-dibromobenzoic acid | CAS Registry Number: 610-71-9
Synonyms: 2,5-Dibromobenzoic acid, BENZOIC ACID, 2,5-DIBROMO-, 516759_ALDRICH, EINECS 210-234-7, NSC190697, NSC 190697, CID11891, BRN 1868193, LS-36757, ST5408571, TL8003864, 4-09-00-01027 (Beilstein Handbook Reference)

Molecular Formula:	C₇H₄Br₂O₂	Molecular Weight:	279.913460 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: SQQKOTVDGCJJKI-UHFFFAOYSA-N

• 2-nitro-4-bromobenzoic acid

IUPAC Name: 4-bromo-2-nitrobenzoate | CAS Registry Number: 99277-71-1
Synonyms: ZINC02571659, CID7021384

Molecular Formula:	C₇H₃BrNO₄-	Molecular Weight:	245.007020 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: ZIRHHEZLJGORGU-UHFFFAOYSA-M

• 2-Amino-3-Nitrobenzoic Acid

IUPAC Name: 2-amino-3-nitrobenzoic acid | CAS Registry Number: 606-18-8
Synonyms: 2-Amino-3-nitrobenzoic acid, NSC1162, ZERO/004618, Benzoic acid, 2-amino-3-nitro-, CID219633, GL-0001, TL8003841

Molecular Formula:	C₇H₆N₂O₄	Molecular Weight:	182.133540 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	5

InChIKey: JJPIVRWTAGQTPQ-UHFFFAOYSA-N

• 4-Azaindole

IUPAC Name: 1H-pyrrolo[3,2-b]pyridine | CAS Registry Number: 272-49-1
Synonyms: 4-AZAINDOLE, 1,4-Diazaindene, Ambad403, 1H-Pyrrolo(3,2-b)pyridine, BRN 0109683, CID9226, LS-139468, TL8002199, A-9485, 5-23-06-00303 (Beilstein Handbook Reference)

Molecular Formula:	C₇H₆N₂	Molecular Weight:	118.135940 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: XWIYUCRMWCHYJR-UHFFFAOYSA-N

• 4-Chloro-3-Methylbenzoic acid

IUPAC Name: 4-chloro-3-methylbenzoic acid | CAS Registry Number: 7697-29-2
Synonyms: 4-Chloro-3-methylbenzoic acid, m-Toluic acid, 4-chloro-, Benzoic acid, 4-chloro-3-methyl-, NSC137157, ST5408010, TL8005289

Molecular Formula:	C₈H₇ClO₂	Molecular Weight:	170.592980 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: MRUKIIWRMSYKML-UHFFFAOYSA-N

• 3-nitro-4-bromomethylbenzoic acid

IUPAC Name: 4-(bromomethyl)-3-nitrobenzoate | CAS Registry Number: 55715-03-2
Synonyms: ZINC00032329, CID3625695

Molecular Formula:	C₈H₅BrNO₄-	Molecular Weight:	259.033600 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: QMAHVAFURJBOFV-UHFFFAOYSA-M

• 2,3-dichlore thiophenol

IUPAC Name: 2,3-dichlorobenzenethiol | CAS Registry Number: 17231-95-7
Synonyms: 2,3-Dichlorobenzenethiol, 2,3-Dichlorothiophenol, 662526_ALDRICH, ST5411422, TL8006735

Molecular Formula:	C₆H₄Cl₂S	Molecular Weight:	179.066960 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: QGRKONUHHGBHRB-UHFFFAOYSA-N

• 4-trifluoromethyl thiobenzamide

IUPAC Name: 4-(trifluoromethyl)benzenecarbothioamide | CAS Registry Number: 72505-21-6
Synonyms: 4-(Trifluoromethyl)thiobenzamide, Maybridge1_006395, 4-(Trifluoromethyl)benzenecarbothioamide, ZINC00076923, RF 03219, T293, TL8005066

Molecular Formula:	C₈H₆F₃NS	Molecular Weight:	205.200150 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: IPRFNMJROWWFBH-UHFFFAOYSA-N

• 1,4-Benzodioxane

IUPAC Name: 2,3-dihydro-1,4-benzodioxine | CAS Registry Number: 493-09-4
Synonyms: 1,4-BENZODIOXAN, Benzo-1,4-dioxane, Pyrocatechol ethylene ether, Ethylene o-phenylene dioxide, 1,2-(Ethylenedioxy)benzene, 1,4-Benzodioxin, 2,3-dihydro-, 1,2-Ethylenedioxybenzene, 2,3-Dihydro-1,4-benzodioxin, 1,4-Benzodioxan (8CI), 179000_ALDRICH, 2,3-Dihydro-1,4-benzodioxine, EINECS 207-775-6, NSC 406705, BTB 12188, NSC406705, ZINC03861305, AI3-05084, Benzene, 1,2-(1,2-ethanediylbis(oxy))-, LS-34567, Benzene, 1,2-[1,2-ethanediylbis(oxy)]-

Molecular Formula:	C₈H₈O₂	Molecular Weight:	136.147920 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: BNBQRQQYDMDJAH-UHFFFAOYSA-N

• 2-hydroxy-3-nitrobenzaldehyde

IUPAC Name: 2-hydroxy-3-nitrobenzaldehyde | CAS Registry Number: 5274-70-4
Synonyms: 3-Nitrosalicylaldehyde, Salicylaldehyde, 3-nitro-, 2-Hydroxy-3-nitrobenzaldehyde, 3-Nitro-2-hydroxybenzaldehyde, Benzaldehyde, 2-hydroxy-3-nitro-, 527424_ALDRICH, NSC38026, CID78934, EINECS 226-098-7, NSC 38026

Molecular Formula:	C₇H₅NO₄	Molecular Weight:	167.118900 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: NUGOTBXFVWXVTE-UHFFFAOYSA-N

• 4-Fluoro-3-methylbenzaldehyde

IUPAC Name: 4-fluoro-3-methylbenzaldehyde | CAS Registry Number: 135427-08-6
Synonyms: 515132_ALDRICH, ZINC00157240, JRD-1136, CID2734874, TL8000828, InChI=1/C8H7FO/c1-6-4-7(5-10)2-3-8(6)9/h2-5H,1H

Molecular Formula:	C₈H₇FO	Molecular Weight:	138.138983 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: NRFKZFFVTGGEQF-UHFFFAOYSA-N

• 5-chloro-2-bromobenzaldehyde

IUPAC Name: 2-bromo-5-chlorobenzaldehyde | CAS Registry Number: 174265-12-4
Synonyms: 2-Bromo-5-chlorobenzaldehyde, 5-CHLORO-2-BROMOBENZALDEHYDE, PubChem19849, ACMC-1BWMM, AGN-PC-00P3QQ, KSC174I5N, CTK0H4456, IIISHLMCTDMUHH-UHFFFAOYSA-, Benzaldehyde, 2-bromo-5-chloro-, MolPort-001-769-835, ANW-22705, CL8256, OR6701, WT1705, ZINC12956408, AKOS005257149, AG-A-84823, AG-E-23861, AS02865, AS03932

Molecular Formula:	C₇H₄BrClO	Molecular Weight:	219.463060 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: IIISHLMCTDMUHH-UHFFFAOYSA-N

• 2,3-dimethylbenzaldehyde

IUPAC Name: 2,3-dimethylbenzaldehyde | CAS Registry Number: 5779-93-1
Synonyms: 2,3-Dimethylbenzaldehyde, o-Xylene-3-carboxaldehyde, Benzaldehyde, dimethyl-, Benzaldehyde, 2,3-dimethyl-, SBB062996, 28351-09-9, Hemellitaldehyde, Dimethylformylbenzene, PubChem3080, DIMETHYLBENZALDEHYDE, ACMC-1AKE8, AC1L1R6U, AC1Q2DP0, KSC206C0T, AGN-PC-0D91D9, 515353_ALDRICH, 2,3-DIMETHYLBENZALDEHYD, CTK1A6109, MolPort-001-769-837, ACT00386

Molecular Formula:	C₉H₁₀O	Molecular Weight:	134.175100 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: UIFVCPMLQXKEEU-UHFFFAOYSA-N

• 5-bromo-2-fluorobenzaldehyde

IUPAC Name: 4-bromo-2-fluorobenzaldehyde | CAS Registry Number: 93777-26-5
Synonyms: 4-Bromo-2-fluorobenzaldehyde, 2-Fluoro-4-bromobenzaldehyde, 5-Bromo-2-fluorobenzaldehyde, 465232_ALDRICH, EINECS 298-056-6, ZINC01081226, B137, ST5307268, TL8003718, 57848-46-1

Molecular Formula:	C₇H₄BrFO	Molecular Weight:	203.008463 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: UPCARQPLANFGQJ-UHFFFAOYSA-N

• 5-chloro-2-fluorobenzaldehyde

IUPAC Name: 5-chloro-2-fluorobenzaldehyde | CAS Registry Number: 96515-79-6
Synonyms: 5-Chloro-2-fluorobenzaldehyde, 5-Chloro-2-fluoro-benzaldehyde, ZINC02243374, BB_SC-4545, JRD-1598, CID2773586, TL8006008

Molecular Formula:	C₇H₄ClFO	Molecular Weight:	158.557463 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: WDTUCEMLUHTMCB-UHFFFAOYSA-N

• 2-Chloro-3-methylquinolin

IUPAC Name: 2-chloro-3-methylquinoline | CAS Registry Number: 57876-69-4
Synonyms: 2-Chloro-3-methyl-quinoline, NSC364026, CID339082, ZINC00162139, ST5214660, TL8003720, UX00000079

Molecular Formula:	C₁₀H₈ClN	Molecular Weight:	177.630220 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: UMYPPRQNLXTIEQ-UHFFFAOYSA-N