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.

46 – 60 of 622 results

Methyl 4-hydroxy-3-nitrobenzoate, 98+%

CAS: 99-42-3 Molecular Formula: C8H7NO5 Molecular Weight (g/mol): 197.146 MDL Number: MFCD00014695 InChI Key: GNCWCTBHZCBXGL-UHFFFAOYSA-N Synonym: methyl 3-nitro-4-hydroxybenzoate,benzoic acid, 4-hydroxy-3-nitro-, methyl ester,4-hydroxy-3-nitrobenzoic acid methyl ester,methyl 3-nitro-4-hydroxy toluate,aurora 6897,3-nitro-4-hydroxybenzoic acid methyl ester,methyl-4-hydroxy-3-nitrobenzoic acid,3-nitro-4-hydroxymethylbenzoate,acmc-209scn,3-10-00-00378 beilstein handbook reference PubChem CID: 66835 IUPAC Name: methyl 4-hydroxy-3-nitrobenzoate SMILES: COC(=O)C1=CC(=C(C=C1)O)[N+](=O)[O-]

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PubChem CID	66835
CAS	99-42-3
Molecular Weight (g/mol)	197.146
MDL Number	MFCD00014695
SMILES	COC(=O)C1=CC(=C(C=C1)O)[N+](=O)[O-]
Synonym	methyl 3-nitro-4-hydroxybenzoate,benzoic acid, 4-hydroxy-3-nitro-, methyl ester,4-hydroxy-3-nitrobenzoic acid methyl ester,methyl 3-nitro-4-hydroxy toluate,aurora 6897,3-nitro-4-hydroxybenzoic acid methyl ester,methyl-4-hydroxy-3-nitrobenzoic acid,3-nitro-4-hydroxymethylbenzoate,acmc-209scn,3-10-00-00378 beilstein handbook reference
IUPAC Name	methyl 4-hydroxy-3-nitrobenzoate
InChI Key	GNCWCTBHZCBXGL-UHFFFAOYSA-N
Molecular Formula	C8H7NO5

Methyl 3-methoxy-2-nitrobenzoate, 98%, Thermo Scientific Chemicals

CAS: 5307-17-5 Molecular Formula: C9H9NO5 Molecular Weight (g/mol): 211.17 MDL Number: MFCD00051968 InChI Key: FDQQRLPHAAICCR-UHFFFAOYSA-N Synonym: benzoic acid, 3-methoxy-2-nitro-, methyl ester,3-methoxy-2-nitrobenzoic acid methyl ester,m-anisic acid, 2-nitro-, methyl ester,maybridge1_002124,cbmicro_008502,methyl 2-nitro-m-anisate,methyl 3-methoxy-2-nitro-benzoate,2-nitro-m-anisic acid methyl ester,3-methoxy-2-nitro-benzoic acid methyl ester PubChem CID: 79195 IUPAC Name: methyl 3-methoxy-2-nitrobenzoate SMILES: COC(=O)C1=CC=CC(OC)=C1[N+]([O-])=O

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PubChem CID	79195
CAS	5307-17-5
Molecular Weight (g/mol)	211.17
MDL Number	MFCD00051968
SMILES	COC(=O)C1=CC=CC(OC)=C1[N+]([O-])=O
Synonym	benzoic acid, 3-methoxy-2-nitro-, methyl ester,3-methoxy-2-nitrobenzoic acid methyl ester,m-anisic acid, 2-nitro-, methyl ester,maybridge1_002124,cbmicro_008502,methyl 2-nitro-m-anisate,methyl 3-methoxy-2-nitro-benzoate,2-nitro-m-anisic acid methyl ester,3-methoxy-2-nitro-benzoic acid methyl ester
IUPAC Name	methyl 3-methoxy-2-nitrobenzoate
InChI Key	FDQQRLPHAAICCR-UHFFFAOYSA-N
Molecular Formula	C9H9NO5

Methyl 4-nitrobenzoate, 99%

CAS: 619-50-1 Molecular Formula: C8H7NO4 Molecular Weight (g/mol): 181.147 MDL Number: MFCD00007350 InChI Key: YOJAHJGBFDPSDI-UHFFFAOYSA-N Synonym: methyl p-nitrobenzoate,benzoic acid, 4-nitro-, methyl ester,p-nitrobenzoic acid methyl ester,methyl-p-nitrobenzoate,methyl-4-nitrobenzoate,benzoic acid, p-nitro-, methyl ester,p-carbomethoxynitrobenzene,unii-nmn8cth864,nmn8cth864,4-nitrobenzoic acid methyl ester PubChem CID: 12083 IUPAC Name: methyl 4-nitrobenzoate SMILES: COC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

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PubChem CID	12083
CAS	619-50-1
Molecular Weight (g/mol)	181.147
MDL Number	MFCD00007350
SMILES	COC(=O)C1=CC=C(C=C1)[N+](=O)[O-]
Synonym	methyl p-nitrobenzoate,benzoic acid, 4-nitro-, methyl ester,p-nitrobenzoic acid methyl ester,methyl-p-nitrobenzoate,methyl-4-nitrobenzoate,benzoic acid, p-nitro-, methyl ester,p-carbomethoxynitrobenzene,unii-nmn8cth864,nmn8cth864,4-nitrobenzoic acid methyl ester
IUPAC Name	methyl 4-nitrobenzoate
InChI Key	YOJAHJGBFDPSDI-UHFFFAOYSA-N
Molecular Formula	C8H7NO4

2-Amino-3-nitrobenzoic acid, 97%, Thermo Scientific Chemicals

CAS: 606-18-8 Molecular Formula: C₇H₆N₂O₄ Molecular Weight (g/mol): 182.13 InChI Key: JJPIVRWTAGQTPQ-UHFFFAOYSA-N Synonym: 2-amino-3-nitrobenzoic acid,3-nitroanthranilic acid,benzoic acid, 2-amino-3-nitro,2-amino-3-nitrobenzonic acid,2-amino-3-nitro-benzoic acid,2-amino-3-nitro benzoic acid,pubchem2233,amino-3-nitrobenzoic acid,2-amino-nitro-benzoesaure,2-carboxy-6-nitroaniline PubChem CID: 219633 SMILES: C1=CC(=C(C(=C1)[N+](=O)[O-])N)C(=O)O

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PubChem CID	219633
CAS	606-18-8
Molecular Weight (g/mol)	182.13
SMILES	C1=CC(=C(C(=C1)[N+](=O)[O-])N)C(=O)O
Synonym	2-amino-3-nitrobenzoic acid,3-nitroanthranilic acid,benzoic acid, 2-amino-3-nitro,2-amino-3-nitrobenzonic acid,2-amino-3-nitro-benzoic acid,2-amino-3-nitro benzoic acid,pubchem2233,amino-3-nitrobenzoic acid,2-amino-nitro-benzoesaure,2-carboxy-6-nitroaniline
InChI Key	JJPIVRWTAGQTPQ-UHFFFAOYSA-N
Molecular Formula	C₇H₆N₂O₄

5-chloro-2-nitrobenzoic acid, 99%

CAS: 2516-95-2 Molecular Formula: C₇H₄ClNO₄ Molecular Weight (g/mol): 201.57 MDL Number: MFCD00007290 InChI Key: ZKUYSJHXBFFGPU-UHFFFAOYSA-N Synonym: 5-chloro-2-nitrobenzoic acid,benzoic acid, 5-chloro-2-nitro,2-nitro-5-chlorobenzoic acid,3-chloro-6-nitrobenzoic acid,5-chloro-2-nitro-benzoic acid,pubchem4586,acmc-209ghs,rarechem al bo 1106,timtec-bb sbb009922,2-nitro-5-chlorobenzoate PubChem CID: 17286 SMILES: C1=CC(=C(C=C1Cl)C(=O)O)[N+](=O)[O-]

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PubChem CID	17286
CAS	2516-95-2
Molecular Weight (g/mol)	201.57
MDL Number	MFCD00007290
SMILES	C1=CC(=C(C=C1Cl)C(=O)O)[N+](=O)[O-]
Synonym	5-chloro-2-nitrobenzoic acid,benzoic acid, 5-chloro-2-nitro,2-nitro-5-chlorobenzoic acid,3-chloro-6-nitrobenzoic acid,5-chloro-2-nitro-benzoic acid,pubchem4586,acmc-209ghs,rarechem al bo 1106,timtec-bb sbb009922,2-nitro-5-chlorobenzoate
InChI Key	ZKUYSJHXBFFGPU-UHFFFAOYSA-N
Molecular Formula	C₇H₄ClNO₄

2,4-Dinitrobenzoic acid, 98%

CAS: 610-30-0 Molecular Formula: C7H4N2O6 Molecular Weight (g/mol): 212.117 MDL Number: MFCD00017006 InChI Key: ZIIGSRYPZWDGBT-UHFFFAOYSA-N Synonym: 2,4-dinitrobenzoic acid,benzoic acid, 2,4-dinitro,ccris 1766,acmc-20aoc2,2.4-dinitrobenzoic acid,benzoicacid, 2,4-dinitro,2,4-dinitrobenzoic acidanion,4-09-00-01239 beilstein handbook reference,aronis26960,1-carboxy-2,4-dinitrobenzene PubChem CID: 11880 SMILES: C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)O

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PubChem CID	11880
CAS	610-30-0
Molecular Weight (g/mol)	212.117
MDL Number	MFCD00017006
SMILES	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)O
Synonym	2,4-dinitrobenzoic acid,benzoic acid, 2,4-dinitro,ccris 1766,acmc-20aoc2,2.4-dinitrobenzoic acid,benzoicacid, 2,4-dinitro,2,4-dinitrobenzoic acidanion,4-09-00-01239 beilstein handbook reference,aronis26960,1-carboxy-2,4-dinitrobenzene
InChI Key	ZIIGSRYPZWDGBT-UHFFFAOYSA-N
Molecular Formula	C7H4N2O6

2-Nitrobenzoic acid, 95%

CAS: 552-16-9 Molecular Formula: C₇H₅NO₄ Molecular Weight (g/mol): 167.12 MDL Number: MFCD00007137 InChI Key: SLAMLWHELXOEJZ-UHFFFAOYSA-N Synonym: 2-nitrobenzoic acid,o-nitrobenzoic acid,benzoic acid, 2-nitro,2-nitrobenzoicacid,o-carboxynitrobenzene,benzoic acid, o-nitro,nitrobenzoic acid,2-nitro-benzoic acid,ccris 2334,2-nitro benzoic acid PubChem CID: 11087 ChEBI: CHEBI:25620 SMILES: C1=CC=C(C(=C1)C(=O)O)[N+](=O)[O-]

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PubChem CID	11087
CAS	552-16-9
Molecular Weight (g/mol)	167.12
ChEBI	CHEBI:25620
MDL Number	MFCD00007137
SMILES	C1=CC=C(C(=C1)C(=O)O)[N+](=O)[O-]
Synonym	2-nitrobenzoic acid,o-nitrobenzoic acid,benzoic acid, 2-nitro,2-nitrobenzoicacid,o-carboxynitrobenzene,benzoic acid, o-nitro,nitrobenzoic acid,2-nitro-benzoic acid,ccris 2334,2-nitro benzoic acid
InChI Key	SLAMLWHELXOEJZ-UHFFFAOYSA-N
Molecular Formula	C₇H₅NO₄

4-Nitrophthalic acid, 97%

CAS: 610-27-5 Molecular Formula: C8H5NO6 Molecular Weight (g/mol): 211.129 MDL Number: MFCD00007252 InChI Key: SLBQXWXKPNIVSQ-UHFFFAOYSA-N Synonym: 4-nitrophthalic acid,5-nitrophthalic acid,4-nitrobenzene-1,2-dicarboxylic acid,1,2-benzenedicarboxylic acid, 4-nitro,phthalic acid, 4-nitro,4-nitrophthalicacid,p-nitrophthalic acid,4-nitro-phthalic acid,acmc-209mo8 PubChem CID: 69121 SMILES: C1=CC(=C(C=C1[N+](=O)[O-])C(=O)O)C(=O)O

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PubChem CID	69121
CAS	610-27-5
Molecular Weight (g/mol)	211.129
MDL Number	MFCD00007252
SMILES	C1=CC(=C(C=C1[N+](=O)[O-])C(=O)O)C(=O)O
Synonym	4-nitrophthalic acid,5-nitrophthalic acid,4-nitrobenzene-1,2-dicarboxylic acid,1,2-benzenedicarboxylic acid, 4-nitro,phthalic acid, 4-nitro,4-nitrophthalicacid,p-nitrophthalic acid,4-nitro-phthalic acid,acmc-209mo8
InChI Key	SLBQXWXKPNIVSQ-UHFFFAOYSA-N
Molecular Formula	C8H5NO6

4-Amino-3-nitrobenzoic acid, 98%, Thermo Scientific™

CAS: 1588-83-6 Molecular Formula: C₇H₆N₂O₄ Molecular Weight (g/mol): 182.14 MDL Number: MFCD00017009 InChI Key: ZZNAYFWAXZJITH-UHFFFAOYSA-N Synonym: 4-amino-3-nitrobenzoic acid,3-nitro-4-aminobenzoic acid,benzoic acid, 4-amino-3-nitro,4-carboxy-2-nitroaniline,3-nitro-4-aminobenozic acid,4-amino-3-nitro-benzoic acid,4-amino-3-nitrobenzoicacid,pubchem4982,rarechem al bo 0261,2-nitro-4-carboxyaniline PubChem CID: 74115 SMILES: C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])N

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PubChem CID	74115
CAS	1588-83-6
Molecular Weight (g/mol)	182.14
MDL Number	MFCD00017009
SMILES	C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])N
Synonym	4-amino-3-nitrobenzoic acid,3-nitro-4-aminobenzoic acid,benzoic acid, 4-amino-3-nitro,4-carboxy-2-nitroaniline,3-nitro-4-aminobenozic acid,4-amino-3-nitro-benzoic acid,4-amino-3-nitrobenzoicacid,pubchem4982,rarechem al bo 0261,2-nitro-4-carboxyaniline
InChI Key	ZZNAYFWAXZJITH-UHFFFAOYSA-N
Molecular Formula	C₇H₆N₂O₄

4-Methyl-3-nitrobenzoic acid, 99%

CAS: 96-98-0 Molecular Formula: C₈H₇NO₄ Molecular Weight (g/mol): 181.15 MDL Number: MFCD00007174 InChI Key: BBEWSMNRCUXQRF-UHFFFAOYSA-N PubChem CID: 7319 SMILES: CC1=C(C=C(C=C1)C(=O)O)[N+](=O)[O-]

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PubChem CID	7319
CAS	96-98-0
Molecular Weight (g/mol)	181.15
MDL Number	MFCD00007174
SMILES	CC1=C(C=C(C=C1)C(=O)O)[N+](=O)[O-]
InChI Key	BBEWSMNRCUXQRF-UHFFFAOYSA-N
Molecular Formula	C₈H₇NO₄

2,6-Dimethoxy-3-nitrobenzoic acid, 97%

CAS: 55776-17-5 Molecular Formula: C9H9NO6 Molecular Weight (g/mol): 227.172 MDL Number: MFCD00017324 InChI Key: YIKBQFPTPKEFSM-UHFFFAOYSA-N Synonym: 2,6-dimethoxy-3-nitro-benzoic acid,acmc-20ao8d,benzoic acid, 2,6-dimethoxy-3-nitro PubChem CID: 3085094 IUPAC Name: 2,6-dimethoxy-3-nitrobenzoic acid SMILES: COC1=C(C(=C(C=C1)[N+](=O)[O-])OC)C(=O)O

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PubChem CID	3085094
CAS	55776-17-5
Molecular Weight (g/mol)	227.172
MDL Number	MFCD00017324
SMILES	COC1=C(C(=C(C=C1)[N+](=O)[O-])OC)C(=O)O
Synonym	2,6-dimethoxy-3-nitro-benzoic acid,acmc-20ao8d,benzoic acid, 2,6-dimethoxy-3-nitro
IUPAC Name	2,6-dimethoxy-3-nitrobenzoic acid
InChI Key	YIKBQFPTPKEFSM-UHFFFAOYSA-N
Molecular Formula	C9H9NO6

Methyl 3-methyl-4-nitrobenzoate, 97%

CAS: 24078-21-5 Molecular Formula: C9H9NO4 Molecular Weight (g/mol): 195.174 MDL Number: MFCD00085640 InChI Key: IEFONJKJLZFGKQ-UHFFFAOYSA-N Synonym: benzoic acid, 3-methyl-4-nitro-, methyl ester,3-methyl-4-nitrobenzoic acid methyl ester,m-toluic acid, 4-nitro-, methyl ester,methyl 3-methyl-4-nitrobenzenecarboxylate,benzoic acid, 3-methyl-4-nitro, methyl ester,methyl3-methyl-4-nitrobenzoate,pubchem2350,acmc-1cfdu,methyl 4-nitro-m-toluate,ksc205m3d PubChem CID: 260927 IUPAC Name: methyl 3-methyl-4-nitrobenzoate SMILES: CC1=C(C=CC(=C1)C(=O)OC)[N+](=O)[O-]

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PubChem CID	260927
CAS	24078-21-5
Molecular Weight (g/mol)	195.174
MDL Number	MFCD00085640
SMILES	CC1=C(C=CC(=C1)C(=O)OC)[N+](=O)[O-]
Synonym	benzoic acid, 3-methyl-4-nitro-, methyl ester,3-methyl-4-nitrobenzoic acid methyl ester,m-toluic acid, 4-nitro-, methyl ester,methyl 3-methyl-4-nitrobenzenecarboxylate,benzoic acid, 3-methyl-4-nitro, methyl ester,methyl3-methyl-4-nitrobenzoate,pubchem2350,acmc-1cfdu,methyl 4-nitro-m-toluate,ksc205m3d
IUPAC Name	methyl 3-methyl-4-nitrobenzoate
InChI Key	IEFONJKJLZFGKQ-UHFFFAOYSA-N
Molecular Formula	C9H9NO4

2,4-Difluoro-5-nitrobenzoic acid, 97%

CAS: 153775-33-8 Molecular Formula: C7H2F2NO4 Molecular Weight (g/mol): 202.09 MDL Number: MFCD04115713 InChI Key: MDFSGDMPHMKKGB-UHFFFAOYSA-M PubChem CID: 2782822 IUPAC Name: 2,4-difluoro-5-nitrobenzoate SMILES: [O-]C(=O)C1=CC(=C(F)C=C1F)[N+]([O-])=O

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PubChem CID	2782822
CAS	153775-33-8
Molecular Weight (g/mol)	202.09
MDL Number	MFCD04115713
SMILES	[O-]C(=O)C1=CC(=C(F)C=C1F)[N+]([O-])=O
IUPAC Name	2,4-difluoro-5-nitrobenzoate
InChI Key	MDFSGDMPHMKKGB-UHFFFAOYSA-M
Molecular Formula	C7H2F2NO4

Nitroterephthalic acid, 99%

CAS: 610-29-7 Molecular Formula: C8H5NO6 Molecular Weight (g/mol): 211.129 MDL Number: MFCD00007141 InChI Key: QUMITRDILMWWBC-UHFFFAOYSA-N Synonym: nitroterephthalic acid,2-nitroterephthalic acid,2-nitrobenzene-1,4-dicarboxylic acid,1,4-benzenedicarboxylic acid, 2-nitro,terephthalic acid, nitro,2-nitroterephthalicacid,2-nitroterephthalate,5-nitroterephthalic acid,acmc-1au2u PubChem CID: 69122 SMILES: C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])C(=O)O

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PubChem CID	69122
CAS	610-29-7
Molecular Weight (g/mol)	211.129
MDL Number	MFCD00007141
SMILES	C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])C(=O)O
Synonym	nitroterephthalic acid,2-nitroterephthalic acid,2-nitrobenzene-1,4-dicarboxylic acid,1,4-benzenedicarboxylic acid, 2-nitro,terephthalic acid, nitro,2-nitroterephthalicacid,2-nitroterephthalate,5-nitroterephthalic acid,acmc-1au2u
InChI Key	QUMITRDILMWWBC-UHFFFAOYSA-N
Molecular Formula	C8H5NO6

2-Methyl-5-nitrobenzoic acid, 98+%

CAS: 1975-52-6 Molecular Formula: C8H7NO4 Molecular Weight (g/mol): 181.147 MDL Number: MFCD00007371 InChI Key: DJRFJAVPROZZFL-UHFFFAOYSA-N Synonym: 2-methyl-5-nitrobenzoic acid,5-nitro-o-toluic acid,benzoic acid, 2-methyl-5-nitro,2-methyl-5-nitro-benzoic acid,5-nitro-2-methylbenzoic acid,rarechem al bo 0285,5-nitro-2-methyl benzoic acid,2-methyl-5-nitro benzoic acid,pubchem2244 PubChem CID: 519683 SMILES: CC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)O

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Specifications

PubChem CID	519683
CAS	1975-52-6
Molecular Weight (g/mol)	181.147
MDL Number	MFCD00007371
SMILES	CC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)O
Synonym	2-methyl-5-nitrobenzoic acid,5-nitro-o-toluic acid,benzoic acid, 2-methyl-5-nitro,2-methyl-5-nitro-benzoic acid,5-nitro-2-methylbenzoic acid,rarechem al bo 0285,5-nitro-2-methyl benzoic acid,2-methyl-5-nitro benzoic acid,pubchem2244
InChI Key	DJRFJAVPROZZFL-UHFFFAOYSA-N
Molecular Formula	C8H7NO4

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Nitrobenzoic acids and derivatives

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