Nitrobenzenes

Organic compounds that consist of a phenyl group with a nitro functional group substitution in the following structure: C6H5NO2; a nitro group has a nitrogen atom bonded to two oxygen groups in a single and a double bond.

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91 – 105 of 881 results

2-Nitro-4-(trifluoromethoxy)aniline 98.0+%, TCI America™

CAS: 2267-23-4 Molecular Formula: C7H5F3N2O3 Molecular Weight (g/mol): 222.12 MDL Number: MFCD00042326 InChI Key: YCGFVAPIBALHRT-UHFFFAOYSA-N Synonym: 2-nitro-4-trifluoromethoxy aniline,2-amino-5-trifluoromethoxy nitrobenzene,benzenamine, 2-nitro-4-trifluoromethoxy,1-amino-2-nitro-4-trifluoromethoxy benzene,2-nitro-4-trifluoromethoxy phenylamine,4-amino-3-nitro-alpha,alpha,alpha-trifluoroanisole,pubchem8514,acmc-1cnwp,ksc496g9b,2-nitro4-trifluoromethoxyaniline PubChem CID: 2775772 IUPAC Name: 2-nitro-4-(trifluoromethoxy)aniline SMILES: NC1=CC=C(OC(F)(F)F)C=C1[N+]([O-])=O

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PubChem CID	2775772
CAS	2267-23-4
Molecular Weight (g/mol)	222.12
MDL Number	MFCD00042326
SMILES	NC1=CC=C(OC(F)(F)F)C=C1[N+]([O-])=O
Synonym	2-nitro-4-trifluoromethoxy aniline,2-amino-5-trifluoromethoxy nitrobenzene,benzenamine, 2-nitro-4-trifluoromethoxy,1-amino-2-nitro-4-trifluoromethoxy benzene,2-nitro-4-trifluoromethoxy phenylamine,4-amino-3-nitro-alpha,alpha,alpha-trifluoroanisole,pubchem8514,acmc-1cnwp,ksc496g9b,2-nitro4-trifluoromethoxyaniline
IUPAC Name	2-nitro-4-(trifluoromethoxy)aniline
InChI Key	YCGFVAPIBALHRT-UHFFFAOYSA-N
Molecular Formula	C7H5F3N2O3

N-Methyl-4-nitro-N-[2-(4-nitrophenoxy)ethyl]phenylethylamine 97.0+%, TCI America™

CAS: 115287-37-1 Molecular Formula: C17H19N3O5 Molecular Weight (g/mol): 345.36 MDL Number: MFCD08236712 InChI Key: BDCVRCLAXLOSLH-UHFFFAOYSA-N PubChem CID: 14645090 IUPAC Name: methyl[2-(4-nitrophenoxy)ethyl][2-(4-nitrophenyl)ethyl]amine SMILES: CN(CCOC1=CC=C(C=C1)[N+]([O-])=O)CCC1=CC=C(C=C1)[N+]([O-])=O

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PubChem CID	14645090
CAS	115287-37-1
Molecular Weight (g/mol)	345.36
MDL Number	MFCD08236712
SMILES	CN(CCOC1=CC=C(C=C1)[N+]([O-])=O)CCC1=CC=C(C=C1)[N+]([O-])=O
IUPAC Name	methyl[2-(4-nitrophenoxy)ethyl][2-(4-nitrophenyl)ethyl]amine
InChI Key	BDCVRCLAXLOSLH-UHFFFAOYSA-N
Molecular Formula	C17H19N3O5

4-Methoxy-2-nitroaniline 98.0+%, TCI America™

CAS: 96-96-8 Molecular Formula: C7H8N2O3 Molecular Weight (g/mol): 168.152 MDL Number: MFCD00007152 InChI Key: QFMJFXFXQAFGBO-UHFFFAOYSA-N Synonym: 2-nitro-4-methoxyaniline,4-amino-3-nitroanisole,fast bordeaux gp,2-nitro-p-anisidine,azobase nas,devol bordeaux b,bordeaux gp base,bordeaux gp salt,fast bordeaux gp base,fast bordeaux gp salt PubChem CID: 66793 ChEBI: CHEBI:48973 IUPAC Name: 4-methoxy-2-nitroaniline SMILES: COC1=CC(=C(C=C1)N)[N+](=O)[O-]

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PubChem CID	66793
CAS	96-96-8
Molecular Weight (g/mol)	168.152
ChEBI	CHEBI:48973
MDL Number	MFCD00007152
SMILES	COC1=CC(=C(C=C1)N)[N+](=O)[O-]
Synonym	2-nitro-4-methoxyaniline,4-amino-3-nitroanisole,fast bordeaux gp,2-nitro-p-anisidine,azobase nas,devol bordeaux b,bordeaux gp base,bordeaux gp salt,fast bordeaux gp base,fast bordeaux gp salt
IUPAC Name	4-methoxy-2-nitroaniline
InChI Key	QFMJFXFXQAFGBO-UHFFFAOYSA-N
Molecular Formula	C7H8N2O3

4-Nitroguaiacol 98.0+%, TCI America™

CAS: 3251-56-7 Molecular Formula: C7H7NO4 Molecular Weight (g/mol): 169.136 MDL Number: MFCD00012143 InChI Key: IZLVFLOBTPURLP-UHFFFAOYSA-N Synonym: 4-nitroguaiacol,phenol, 2-methoxy-4-nitro,guaiacol, 4-nitro,2-hydroxy-5-nitroanisole,3-nitro-6-hydroxyanisole,4-hydroxy-3-methoxynitrobenzene,phenol, o-methoxy-p-nitro,o-methoxy-p-nitrophenol,2-methoxy-4-nitro-phenol,4-nitrogualacol PubChem CID: 76738 ChEBI: CHEBI:81050 IUPAC Name: 2-methoxy-4-nitrophenol SMILES: COC1=C(C=CC(=C1)[N+](=O)[O-])O

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PubChem CID	76738
CAS	3251-56-7
Molecular Weight (g/mol)	169.136
ChEBI	CHEBI:81050
MDL Number	MFCD00012143
SMILES	COC1=C(C=CC(=C1)[N+](=O)[O-])O
Synonym	4-nitroguaiacol,phenol, 2-methoxy-4-nitro,guaiacol, 4-nitro,2-hydroxy-5-nitroanisole,3-nitro-6-hydroxyanisole,4-hydroxy-3-methoxynitrobenzene,phenol, o-methoxy-p-nitro,o-methoxy-p-nitrophenol,2-methoxy-4-nitro-phenol,4-nitrogualacol
IUPAC Name	2-methoxy-4-nitrophenol
InChI Key	IZLVFLOBTPURLP-UHFFFAOYSA-N
Molecular Formula	C7H7NO4

3-Chloromethyl-5-nitrosalicylaldehyde 97.0+%, TCI America™

CAS: 16644-30-7 Molecular Formula: C8H6ClNO4 Molecular Weight (g/mol): 215.59 MDL Number: MFCD00191331 InChI Key: VPZKJFJWKLYFQD-UHFFFAOYSA-N PubChem CID: 99380 IUPAC Name: 3-(chloromethyl)-2-hydroxy-5-nitrobenzaldehyde SMILES: OC1=C(CCl)C=C(C=C1C=O)[N+]([O-])=O

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PubChem CID	99380
CAS	16644-30-7
Molecular Weight (g/mol)	215.59
MDL Number	MFCD00191331
SMILES	OC1=C(CCl)C=C(C=C1C=O)[N+]([O-])=O
IUPAC Name	3-(chloromethyl)-2-hydroxy-5-nitrobenzaldehyde
InChI Key	VPZKJFJWKLYFQD-UHFFFAOYSA-N
Molecular Formula	C8H6ClNO4

4-Chloro-2,5-dimethoxynitrobenzene 98.0+%, TCI America™

CAS: 6940-53-0 Molecular Formula: C8H8ClNO4 Molecular Weight (g/mol): 217.605 MDL Number: MFCD00024577 InChI Key: ORLPGMKKCAEWOW-UHFFFAOYSA-N PubChem CID: 81362 IUPAC Name: 1-chloro-2,5-dimethoxy-4-nitrobenzene SMILES: COC1=CC(=C(C=C1[N+](=O)[O-])OC)Cl

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PubChem CID	81362
CAS	6940-53-0
Molecular Weight (g/mol)	217.605
MDL Number	MFCD00024577
SMILES	COC1=CC(=C(C=C1[N+](=O)[O-])OC)Cl
IUPAC Name	1-chloro-2,5-dimethoxy-4-nitrobenzene
InChI Key	ORLPGMKKCAEWOW-UHFFFAOYSA-N
Molecular Formula	C8H8ClNO4

5-Nitroguaiacol Sodium Salt 98.0+%, TCI America™

CAS: 67233-85-6 Molecular Formula: C7H6NNaO4 Molecular Weight (g/mol): 191.12 MDL Number: MFCD00070570 InChI Key: KBRKFTKQRMYINW-UHFFFAOYSA-M Synonym: 2-Methoxy-5-nitrophenol Sodium Salt PubChem CID: 3017748 IUPAC Name: sodium 2-methoxy-5-nitrobenzen-1-olate SMILES: [Na+].COC1=CC=C(C=C1[O-])[N+]([O-])=O

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PubChem CID	3017748
CAS	67233-85-6
Molecular Weight (g/mol)	191.12
MDL Number	MFCD00070570
SMILES	[Na+].COC1=CC=C(C=C1[O-])[N+]([O-])=O
Synonym	2-Methoxy-5-nitrophenol Sodium Salt
IUPAC Name	sodium 2-methoxy-5-nitrobenzen-1-olate
InChI Key	KBRKFTKQRMYINW-UHFFFAOYSA-M
Molecular Formula	C7H6NNaO4

4-Methoxy-3-nitrotoluene 98.0+%, TCI America™

CAS: 119-10-8 Molecular Formula: C8H9NO3 Molecular Weight (g/mol): 167.16 MDL Number: MFCD00024540 InChI Key: LGNMURXRPLMVJI-UHFFFAOYSA-N Synonym: 1-Methoxy-4-methyl-2-nitrobenzene, 4-Methyl-2-nitroanisole PubChem CID: 67058 IUPAC Name: 1-methoxy-4-methyl-2-nitrobenzene SMILES: COC1=CC=C(C)C=C1[N+]([O-])=O

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PubChem CID	67058
CAS	119-10-8
Molecular Weight (g/mol)	167.16
MDL Number	MFCD00024540
SMILES	COC1=CC=C(C)C=C1[N+]([O-])=O
Synonym	1-Methoxy-4-methyl-2-nitrobenzene, 4-Methyl-2-nitroanisole
IUPAC Name	1-methoxy-4-methyl-2-nitrobenzene
InChI Key	LGNMURXRPLMVJI-UHFFFAOYSA-N
Molecular Formula	C8H9NO3

4-Methoxy-3-nitrobenzotrifluoride, TCI America™

CAS: 394-25-2 Molecular Formula: C8H6F3NO3 Molecular Weight (g/mol): 221.135 MDL Number: MFCD00007099 InChI Key: MAAFHLOZHBKYTG-UHFFFAOYSA-N Synonym: 4-methoxy-3-nitrobenzotrifluoride,1-methoxy-2-nitro-4-trifluoromethyl benzene,2-nitro-4-trifluoromethyl anisole,2-nitro-4-trifluoromethylanisole,3-nitro-4-methoxybenzotrifluoride,4-trifluoromethyl-2-nitroanisole,benzene, 1-methoxy-2-nitro-4-trifluoromethyl,4-trifluoromethyl-1-methoxy-2-nitrobenzene,pubchem13493,4-methoxy-3-nitrobezotrifluoride PubChem CID: 96748 IUPAC Name: 1-methoxy-2-nitro-4-(trifluoromethyl)benzene SMILES: COC1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-]

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PubChem CID	96748
CAS	394-25-2
Molecular Weight (g/mol)	221.135
MDL Number	MFCD00007099
SMILES	COC1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-]
Synonym	4-methoxy-3-nitrobenzotrifluoride,1-methoxy-2-nitro-4-trifluoromethyl benzene,2-nitro-4-trifluoromethyl anisole,2-nitro-4-trifluoromethylanisole,3-nitro-4-methoxybenzotrifluoride,4-trifluoromethyl-2-nitroanisole,benzene, 1-methoxy-2-nitro-4-trifluoromethyl,4-trifluoromethyl-1-methoxy-2-nitrobenzene,pubchem13493,4-methoxy-3-nitrobezotrifluoride
IUPAC Name	1-methoxy-2-nitro-4-(trifluoromethyl)benzene
InChI Key	MAAFHLOZHBKYTG-UHFFFAOYSA-N
Molecular Formula	C8H6F3NO3

100

2-Bromo-4-methoxy-6-nitrophenol 98.0+%, TCI America™

CAS: 115929-59-4 Molecular Formula: C7H6BrNO4 Molecular Weight (g/mol): 248.032 MDL Number: MFCD06797984 InChI Key: GAVVLRJHVWIDPK-UHFFFAOYSA-N PubChem CID: 11265140 IUPAC Name: 2-bromo-4-methoxy-6-nitrophenol SMILES: COC1=CC(=C(C(=C1)[N+](=O)[O-])O)Br

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PubChem CID	11265140
CAS	115929-59-4
Molecular Weight (g/mol)	248.032
MDL Number	MFCD06797984
SMILES	COC1=CC(=C(C(=C1)[N+](=O)[O-])O)Br
IUPAC Name	2-bromo-4-methoxy-6-nitrophenol
InChI Key	GAVVLRJHVWIDPK-UHFFFAOYSA-N
Molecular Formula	C7H6BrNO4

101

2-Chloro-5-nitrobenzaldehyde 96.0+%, TCI America™

CAS: 6361-21-3 Molecular Formula: C7H4ClNO3 Molecular Weight (g/mol): 185.56 MDL Number: MFCD00007293 InChI Key: VFVHWCKUHAEDMY-UHFFFAOYSA-N Synonym: benzaldehyde, 2-chloro-5-nitro,3-nitro-6-chlorobenzaldehyde,2-chloro-5-nitro-benzaldehyde,unii-pf4ill0i3h,pf4ill0i3h,2-chlor-5-nitrobenzaldehyd,pubchem7375,wln: wnr dg cvh,chloro-5-nitrobenzaldehyde,asischem r37046 PubChem CID: 72933 IUPAC Name: 2-chloro-5-nitrobenzaldehyde SMILES: [O-][N+](=O)C1=CC=C(Cl)C(C=O)=C1

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PubChem CID	72933
CAS	6361-21-3
Molecular Weight (g/mol)	185.56
MDL Number	MFCD00007293
SMILES	[O-][N+](=O)C1=CC=C(Cl)C(C=O)=C1
Synonym	benzaldehyde, 2-chloro-5-nitro,3-nitro-6-chlorobenzaldehyde,2-chloro-5-nitro-benzaldehyde,unii-pf4ill0i3h,pf4ill0i3h,2-chlor-5-nitrobenzaldehyd,pubchem7375,wln: wnr dg cvh,chloro-5-nitrobenzaldehyde,asischem r37046
IUPAC Name	2-chloro-5-nitrobenzaldehyde
InChI Key	VFVHWCKUHAEDMY-UHFFFAOYSA-N
Molecular Formula	C7H4ClNO3

102

6-Nitroveratraldehyde 85.0+%, TCI America™

CAS: 20357-25-9 Molecular Formula: C9H9NO5 Molecular Weight (g/mol): 211.17 MDL Number: MFCD00007134 InChI Key: YWSPWKXREVSQCA-UHFFFAOYSA-N Synonym: 6-nitroveratraldehyde,dmnb,3,4-dimethoxy-6-nitrobenzaldehyde,4,5-dimethoxy-2-nitro-benzaldehyde,dna-pk inhibitor,benzaldehyde, 4,5-dimethoxy-2-nitro,2-nitro-4,5-dimethoxybenzaldehyde,dna-dependent protein kinase inhibitor,2-nitro-4,5-bis methyloxy benzaldehyde,pubchem8213 PubChem CID: 88505 IUPAC Name: 4,5-dimethoxy-2-nitrobenzaldehyde SMILES: COC1=CC(C=O)=C(C=C1OC)[N+]([O-])=O

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Specifications

PubChem CID	88505
CAS	20357-25-9
Molecular Weight (g/mol)	211.17
MDL Number	MFCD00007134
SMILES	COC1=CC(C=O)=C(C=C1OC)[N+]([O-])=O
Synonym	6-nitroveratraldehyde,dmnb,3,4-dimethoxy-6-nitrobenzaldehyde,4,5-dimethoxy-2-nitro-benzaldehyde,dna-pk inhibitor,benzaldehyde, 4,5-dimethoxy-2-nitro,2-nitro-4,5-dimethoxybenzaldehyde,dna-dependent protein kinase inhibitor,2-nitro-4,5-bis methyloxy benzaldehyde,pubchem8213
IUPAC Name	4,5-dimethoxy-2-nitrobenzaldehyde
InChI Key	YWSPWKXREVSQCA-UHFFFAOYSA-N
Molecular Formula	C9H9NO5

103

5-Chloro-2-nitrobenzaldehyde 98.0+%, TCI America™

CAS: 6628-86-0 Molecular Formula: C7H4ClNO3 Molecular Weight (g/mol): 185.563 MDL Number: MFCD00007289 InChI Key: SWGPIDCNYAYXMJ-UHFFFAOYSA-N Synonym: 2-nitro-5-chlorobenzaldehyde,5-chloro-2-nitro-benzaldehyde,benzaldehyde, 5-chloro-2-nitro,4-chloro-2-formylnitrobenzene,pubchem8199,acmc-1cuhe,ksc497q2h,5-chloro-2-nitro benzoaldehyde,5-chloro-2-nitrobenzaldehyde, technical grade PubChem CID: 81123 IUPAC Name: 5-chloro-2-nitrobenzaldehyde SMILES: C1=CC(=C(C=C1Cl)C=O)[N+](=O)[O-]

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PubChem CID	81123
CAS	6628-86-0
Molecular Weight (g/mol)	185.563
MDL Number	MFCD00007289
SMILES	C1=CC(=C(C=C1Cl)C=O)[N+](=O)[O-]
Synonym	2-nitro-5-chlorobenzaldehyde,5-chloro-2-nitro-benzaldehyde,benzaldehyde, 5-chloro-2-nitro,4-chloro-2-formylnitrobenzene,pubchem8199,acmc-1cuhe,ksc497q2h,5-chloro-2-nitro benzoaldehyde,5-chloro-2-nitrobenzaldehyde, technical grade
IUPAC Name	5-chloro-2-nitrobenzaldehyde
InChI Key	SWGPIDCNYAYXMJ-UHFFFAOYSA-N
Molecular Formula	C7H4ClNO3

104

4-tert-Butyl-3-methoxy-2,6-dinitrotoluene 99.0+%, TCI America™

CAS: 83-66-9 Molecular Formula: C12H16N2O5 Molecular Weight (g/mol): 268.269 MDL Number: MFCD00024268 InChI Key: SUAUILGSCPYJCS-UHFFFAOYSA-N Synonym: 6-tert-Butyl-3-methyl-2,4-dinitroanisole PubChem CID: 6753 ChEBI: CHEBI:82495 IUPAC Name: 1-tert-butyl-2-methoxy-4-methyl-3,5-dinitrobenzene SMILES: CC1=C(C=C(C(=C1[N+](=O)[O-])OC)C(C)(C)C)[N+](=O)[O-]

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PubChem CID	6753
CAS	83-66-9
Molecular Weight (g/mol)	268.269
ChEBI	CHEBI:82495
MDL Number	MFCD00024268
SMILES	CC1=C(C=C(C(=C1[N+](=O)[O-])OC)C(C)(C)C)[N+](=O)[O-]
Synonym	6-tert-Butyl-3-methyl-2,4-dinitroanisole
IUPAC Name	1-tert-butyl-2-methoxy-4-methyl-3,5-dinitrobenzene
InChI Key	SUAUILGSCPYJCS-UHFFFAOYSA-N
Molecular Formula	C12H16N2O5

105

2-Bromo-5-nitroanisole 98.0+%, TCI America™

CAS: 77337-82-7 Molecular Formula: C7H6BrNO3 Molecular Weight (g/mol): 232.033 MDL Number: MFCD00041250 InChI Key: NTKADLOYTKVXQN-UHFFFAOYSA-N Synonym: 2-bromo-5-nitroanisole,4-bromo-3-methoxynitrobenzene,2-bromo-5-nitroanisol,benzene, 1-bromo-2-methoxy-4-nitro,1-bromo-2-methoxy-4-nitro-benzene,zlchem 673,pubchem2536,2-bromo 5-nitro anisole,2-bromo-5-nitro-anisole,2-bromo-5-nitro anisole PubChem CID: 101293 IUPAC Name: 1-bromo-2-methoxy-4-nitrobenzene SMILES: COC1=C(C=CC(=C1)[N+](=O)[O-])Br

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Specifications

PubChem CID	101293
CAS	77337-82-7
Molecular Weight (g/mol)	232.033
MDL Number	MFCD00041250
SMILES	COC1=C(C=CC(=C1)[N+](=O)[O-])Br
Synonym	2-bromo-5-nitroanisole,4-bromo-3-methoxynitrobenzene,2-bromo-5-nitroanisol,benzene, 1-bromo-2-methoxy-4-nitro,1-bromo-2-methoxy-4-nitro-benzene,zlchem 673,pubchem2536,2-bromo 5-nitro anisole,2-bromo-5-nitro-anisole,2-bromo-5-nitro anisole
IUPAC Name	1-bromo-2-methoxy-4-nitrobenzene
InChI Key	NTKADLOYTKVXQN-UHFFFAOYSA-N
Molecular Formula	C7H6BrNO3

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