Nitrobenzoic acids and derivatives

Organic compounds that consist of benzoic acid with a nitro group substitution; a nitro group has a nitrogen atom bonded to two oxygen groups in a single and a double bond. Includes compounds that are directly derived from nitrobenzoic acid.

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226 – 240 of 1,063 results

226

4-Bromo-3-nitrobenzoic Acid 98.0+%, TCI America™

CAS: 6319-40-0 Molecular Formula: C7H4BrNO4 Molecular Weight (g/mol): 246.016 MDL Number: MFCD00272137 InChI Key: RVCTZJVBWNFYRU-UHFFFAOYSA-N Synonym: 4-bromo-3-nitrobenzoic acid,3-nitro-4-bromobenzoic acid,benzoic acid, 4-bromo-3-nitro,4-bromo-3-nitro-benzoic acid,zlchem 531,pubchem2194,acmc-209ndq,ksc353s1b,4-bromo-3-nitrobenzoic acid # PubChem CID: 232986 SMILES: C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])Br

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PubChem CID	232986
CAS	6319-40-0
Molecular Weight (g/mol)	246.016
MDL Number	MFCD00272137
SMILES	C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])Br
Synonym	4-bromo-3-nitrobenzoic acid,3-nitro-4-bromobenzoic acid,benzoic acid, 4-bromo-3-nitro,4-bromo-3-nitro-benzoic acid,zlchem 531,pubchem2194,acmc-209ndq,ksc353s1b,4-bromo-3-nitrobenzoic acid #
InChI Key	RVCTZJVBWNFYRU-UHFFFAOYSA-N
Molecular Formula	C7H4BrNO4

227

Methyl 2-Bromo-5-nitrobenzoate 98.0+%, TCI America™

CAS: 6942-36-5 Molecular Formula: C8H6BrNO4 Molecular Weight (g/mol): 260.043 MDL Number: MFCD00010867 InChI Key: VSEYYEKRZNRECT-UHFFFAOYSA-N Synonym: 2-bromo-5-nitrobenzoic acid methyl ester,benzoic acid, 2-bromo-5-nitro-, methyl ester,methyl 2-bromo-5-nitro-benzoate,2-bromo-5-nitro-benzoic acid methyl ester,methyl2-bromo-5-nitrobenzoate,pubchem3971,acmc-1b9le,ksc495k5r,methyl 5-nitro-2-bromobenzoate,methyl-2-bromo-5-nitrobenzoate PubChem CID: 245494 IUPAC Name: methyl 2-bromo-5-nitrobenzoate SMILES: COC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])Br

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PubChem CID	245494
CAS	6942-36-5
Molecular Weight (g/mol)	260.043
MDL Number	MFCD00010867
SMILES	COC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])Br
Synonym	2-bromo-5-nitrobenzoic acid methyl ester,benzoic acid, 2-bromo-5-nitro-, methyl ester,methyl 2-bromo-5-nitro-benzoate,2-bromo-5-nitro-benzoic acid methyl ester,methyl2-bromo-5-nitrobenzoate,pubchem3971,acmc-1b9le,ksc495k5r,methyl 5-nitro-2-bromobenzoate,methyl-2-bromo-5-nitrobenzoate
IUPAC Name	methyl 2-bromo-5-nitrobenzoate
InChI Key	VSEYYEKRZNRECT-UHFFFAOYSA-N
Molecular Formula	C8H6BrNO4

228

5-Amino-2-nitrobenzoic Acid (Purified) 99.0+%, TCI America™

CAS: 13280-60-9 Molecular Formula: C7H6N2O4 Molecular Weight (g/mol): 182.135 MDL Number: MFCD00035748 InChI Key: KZZWQCKYLNIOBT-UHFFFAOYSA-N Synonym: 5-amino-2-nitrobenzoic acid,2-nitro-5-aminobenzoic acid,benzoic acid, 5-amino-2-nitro,3-carboxy-4-nitroaniline,5-amino-2-nitro-benzoic acid,pubchem4983,acmc-1bxcb,intermediates-zcf02020,5-amino-2-nitrobenzoicacid,6-nitro-m-anthranilic acid PubChem CID: 83298 SMILES: C1=CC(=C(C=C1N)C(=O)O)[N+](=O)[O-]

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PubChem CID	83298
CAS	13280-60-9
Molecular Weight (g/mol)	182.135
MDL Number	MFCD00035748
SMILES	C1=CC(=C(C=C1N)C(=O)O)[N+](=O)[O-]
Synonym	5-amino-2-nitrobenzoic acid,2-nitro-5-aminobenzoic acid,benzoic acid, 5-amino-2-nitro,3-carboxy-4-nitroaniline,5-amino-2-nitro-benzoic acid,pubchem4983,acmc-1bxcb,intermediates-zcf02020,5-amino-2-nitrobenzoicacid,6-nitro-m-anthranilic acid
InChI Key	KZZWQCKYLNIOBT-UHFFFAOYSA-N
Molecular Formula	C7H6N2O4

229

2-Methyl-3-nitrobenzoic Acid 98.0+%, TCI America™

CAS: 1975-50-4 Molecular Formula: C8H7NO4 Molecular Weight (g/mol): 181.147 MDL Number: MFCD00007160 InChI Key: YPQAFWHSMWWPLX-UHFFFAOYSA-N Synonym: 2-methyl-3-nitrobenzoic acid,3-nitro-o-toluic acid,benzoic acid, 2-methyl-3-nitro,2-methyl-3-nitrobenzoicacid,unii-0si17d349b,3-nitro-2-methyl benzoic acid,3-nitro-2-methylbenzoic acid,2-methyl-3-nitro-benzoic acid,benzoic acid,2-methyl-3-nitro,pubchem4522 PubChem CID: 16096 SMILES: CC1=C(C=CC=C1[N+](=O)[O-])C(=O)O

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PubChem CID	16096
CAS	1975-50-4
Molecular Weight (g/mol)	181.147
MDL Number	MFCD00007160
SMILES	CC1=C(C=CC=C1[N+](=O)[O-])C(=O)O
Synonym	2-methyl-3-nitrobenzoic acid,3-nitro-o-toluic acid,benzoic acid, 2-methyl-3-nitro,2-methyl-3-nitrobenzoicacid,unii-0si17d349b,3-nitro-2-methyl benzoic acid,3-nitro-2-methylbenzoic acid,2-methyl-3-nitro-benzoic acid,benzoic acid,2-methyl-3-nitro,pubchem4522
InChI Key	YPQAFWHSMWWPLX-UHFFFAOYSA-N
Molecular Formula	C8H7NO4

230

4-Methyl-3,5-dinitrobenzoic Acid 98.0+%, TCI America™

CAS: 16533-71-4 Molecular Formula: C8H6N2O6 Molecular Weight (g/mol): 226.14 MDL Number: MFCD00007175 InChI Key: LZWWZQXBKVZKIP-UHFFFAOYSA-N Synonym: 4-methyl-3,5-dinitrobenzoic acid,3,5-dinitro-4-methylbenzoic acid,3,5-dinitro-p-toluic acid,3,5-dinitro-4-methyl benzoic acid,benzoic acid, 4-methyl-3,5-dinitro,p-toluic acid, 3,5-dinitro,acmc-209dsg,p-toluic acid,5-dinitro,ksc496a8j,3,5-dinitro-4-methylbenzoicacid PubChem CID: 85477 IUPAC Name: 4-methyl-3,5-dinitrobenzoic acid SMILES: CC1=C(C=C(C=C1[N+]([O-])=O)C(O)=O)[N+]([O-])=O

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PubChem CID	85477
CAS	16533-71-4
Molecular Weight (g/mol)	226.14
MDL Number	MFCD00007175
SMILES	CC1=C(C=C(C=C1[N+]([O-])=O)C(O)=O)[N+]([O-])=O
Synonym	4-methyl-3,5-dinitrobenzoic acid,3,5-dinitro-4-methylbenzoic acid,3,5-dinitro-p-toluic acid,3,5-dinitro-4-methyl benzoic acid,benzoic acid, 4-methyl-3,5-dinitro,p-toluic acid, 3,5-dinitro,acmc-209dsg,p-toluic acid,5-dinitro,ksc496a8j,3,5-dinitro-4-methylbenzoicacid
IUPAC Name	4-methyl-3,5-dinitrobenzoic acid
InChI Key	LZWWZQXBKVZKIP-UHFFFAOYSA-N
Molecular Formula	C8H6N2O6

231

5-Methyl-2-nitrobenzoic Acid 98.0+%, TCI America™

CAS: 3113-72-2 Molecular Formula: C8H7NO4 Molecular Weight (g/mol): 181.147 MDL Number: MFCD00007368 InChI Key: QRRSIFNWHCKMSW-UHFFFAOYSA-N Synonym: 5-methyl-2-nitrobenzoic acid,2-nitro-5-methylbenzoic acid,benzoic acid, 5-methyl-2-nitro,3-methyl-6-nitrobenzoic acid,6-nitro-m-toluic acid,m-toluic acid, 6-nitro,6-nitro-p-toluic acid,5-methyl-2-nitrobenzoicacid,5-methyl-2-nitro-benzoic acid,benzoic acid,5-methyl-2-nitro PubChem CID: 18371 SMILES: CC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)O

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PubChem CID	18371
CAS	3113-72-2
Molecular Weight (g/mol)	181.147
MDL Number	MFCD00007368
SMILES	CC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)O
Synonym	5-methyl-2-nitrobenzoic acid,2-nitro-5-methylbenzoic acid,benzoic acid, 5-methyl-2-nitro,3-methyl-6-nitrobenzoic acid,6-nitro-m-toluic acid,m-toluic acid, 6-nitro,6-nitro-p-toluic acid,5-methyl-2-nitrobenzoicacid,5-methyl-2-nitro-benzoic acid,benzoic acid,5-methyl-2-nitro
InChI Key	QRRSIFNWHCKMSW-UHFFFAOYSA-N
Molecular Formula	C8H7NO4

232

4-Ethoxycarbonyl-2-nitrophenylboronic Acid (contains varying amounts of Anhydride) 98.0+%, TCI America™

CAS: 5785-70-6 Molecular Formula: C9H10BNO6 Molecular Weight (g/mol): 238.99 MDL Number: MFCD02179460 InChI Key: GCDAYMSNTGTFDC-UHFFFAOYSA-N Synonym: 4-ethoxycarbonyl-2-nitrophenyl boronic acid,ethyl 4-borono-3-nitrabenzoate,ethyl 4-borono-3-nitrobenzoate,4-ethoxycarbonyl-2-nitrophenylboronic acid,4-ethoxycarbonyl-2-nitrobenzeneboronic acid,4-ethoxycarbonyl-2-nitrophenylboronicacid,acmc-1alqp,chembl91674,benzoic acid,4-borono-3-nitro-, 1-ethyl ester PubChem CID: 2773403 IUPAC Name: (4-ethoxycarbonyl-2-nitrophenyl)boronic acid SMILES: B(C1=C(C=C(C=C1)C(=O)OCC)[N+](=O)[O-])(O)O

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PubChem CID	2773403
CAS	5785-70-6
Molecular Weight (g/mol)	238.99
MDL Number	MFCD02179460
SMILES	B(C1=C(C=C(C=C1)C(=O)OCC)[N+](=O)[O-])(O)O
Synonym	4-ethoxycarbonyl-2-nitrophenyl boronic acid,ethyl 4-borono-3-nitrabenzoate,ethyl 4-borono-3-nitrobenzoate,4-ethoxycarbonyl-2-nitrophenylboronic acid,4-ethoxycarbonyl-2-nitrobenzeneboronic acid,4-ethoxycarbonyl-2-nitrophenylboronicacid,acmc-1alqp,chembl91674,benzoic acid,4-borono-3-nitro-, 1-ethyl ester
IUPAC Name	(4-ethoxycarbonyl-2-nitrophenyl)boronic acid
InChI Key	GCDAYMSNTGTFDC-UHFFFAOYSA-N
Molecular Formula	C9H10BNO6

233

5-Nitroisophthalic Acid 99.0+%, TCI America™

CAS: 618-88-2 Molecular Formula: C8H5NO6 Molecular Weight (g/mol): 211.129 MDL Number: MFCD00007254 InChI Key: NBDAHKQJXVLAID-UHFFFAOYSA-N Synonym: 5-nitroisophthalic acid,5-nitrobenzene-1,3-dicarboxylic acid,5-nitro-1,3-benzenedicarboxylic acid,1,3-benzenedicarboxylic acid, 5-nitro,5-nitroisophthalicacid,5-nitro-m-phthalic acid,unii-g7rz7lc76u,isophthalic acid, 5-nitro,1-nitrobenzene-3,5-dicarboxylic acid,g7rz7lc76u PubChem CID: 12069 SMILES: C1=C(C=C(C=C1C(=O)O)[N+](=O)[O-])C(=O)O

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PubChem CID	12069
CAS	618-88-2
Molecular Weight (g/mol)	211.129
MDL Number	MFCD00007254
SMILES	C1=C(C=C(C=C1C(=O)O)[N+](=O)[O-])C(=O)O
Synonym	5-nitroisophthalic acid,5-nitrobenzene-1,3-dicarboxylic acid,5-nitro-1,3-benzenedicarboxylic acid,1,3-benzenedicarboxylic acid, 5-nitro,5-nitroisophthalicacid,5-nitro-m-phthalic acid,unii-g7rz7lc76u,isophthalic acid, 5-nitro,1-nitrobenzene-3,5-dicarboxylic acid,g7rz7lc76u
InChI Key	NBDAHKQJXVLAID-UHFFFAOYSA-N
Molecular Formula	C8H5NO6

234

Sigma Aldrich 3-Bromo[1,1'-biphenyl]-4-ol

MilliporeSigma Sigma Organics products encompass a wide range of quality reagents, solvents, catalysts, and building blocks for organic synthesis. From benchtop discovery to process development and scale-up, Sigma Organics solutions are built to meet the needs of synthetic chemists.

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CAS	92-03-5

235

Percent Purity	99%
Linear Formula	O2NC6H4CO2H
CAS	121-92-6
Molecular Weight (g/mol)	167.12
MDL Number	MFCD00007251
RTECS Number	DH5000000
Recommended Storage	Room Temperature
Molecular Formula	C7H5NO4
EINECS Number	204-508-5
Melting Point	139°C to 141°C (lit.)