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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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1 – 15 of 160 results
1

5-Nitrovanillin, 97%

CAS: 6635-20-7 Molecular Formula: C8H7NO5 Molecular Weight (g/mol): 197.146 MDL Number: MFCD00007118 InChI Key: ZEHYRTJBFMZHCY-UHFFFAOYSA-N Synonym: 5-nitrovanillin,4-hydroxy-3-methoxy-5-nitrobenzaldehyde,vanillin, 5-nitro,benzaldehyde, 4-hydroxy-3-methoxy-5-nitro,3-methoxy-4-hydroxy-5-nitrobenzaldhyde,3-methoxy-4-hydroxy-5-nitrobenzaldehyde,4-hydroxy-3-methoxy-5-nitro-benzaldehyde,4-hydroxy-3-nitro-5-methoxybenzaldehyde,4-hydroxy-5-methoxy-3-nitrobenzaldehyde,5-nitrovanilline PubChem CID: 81134 ChEBI: CHEBI:48385 SMILES: COC1=CC(=CC(=C1O)[N+](=O)[O-])C=O

PubChem CID 81134
CAS 6635-20-7
Molecular Weight (g/mol) 197.146
ChEBI CHEBI:48385
MDL Number MFCD00007118
SMILES COC1=CC(=CC(=C1O)[N+](=O)[O-])C=O
Synonym 5-nitrovanillin,4-hydroxy-3-methoxy-5-nitrobenzaldehyde,vanillin, 5-nitro,benzaldehyde, 4-hydroxy-3-methoxy-5-nitro,3-methoxy-4-hydroxy-5-nitrobenzaldhyde,3-methoxy-4-hydroxy-5-nitrobenzaldehyde,4-hydroxy-3-methoxy-5-nitro-benzaldehyde,4-hydroxy-3-nitro-5-methoxybenzaldehyde,4-hydroxy-5-methoxy-3-nitrobenzaldehyde,5-nitrovanilline
InChI Key ZEHYRTJBFMZHCY-UHFFFAOYSA-N
Molecular Formula C8H7NO5
2

N-(3-Hydroxyphenyl)thiourea, 97%

CAS: 3394-05-6 MDL Number: MFCD00022167

CAS 3394-05-6
MDL Number MFCD00022167
3

5-Bromo-3-nitrosalicylaldehyde, 97%

CAS: 16634-88-1 Molecular Formula: C7H4BrNO4 Molecular Weight (g/mol): 246.016 MDL Number: MFCD00130110 InChI Key: YEYPSUQQZNDKDE-UHFFFAOYSA-N Synonym: 5-bromo-2-hydroxy-3-nitrobenzaldehyde,5-bromo-3-nitrosalicylaldehyde,benzaldehyde, 5-bromo-2-hydroxy-3-nitro,3-nitro-5-bromosalicylaldehyde,benzaldehyde,5-bromo-2-hydroxy-3-nitro,salicylaldehyde, 5-bromo-3-nitro,acmc-209du3,5-bromo-3-nitrosalicyladehyde,2-hydroxy-3-nitro-5-bromobenzaldehyde PubChem CID: 618699 SMILES: C1=C(C=C(C(=C1[N+](=O)[O-])O)C=O)Br

PubChem CID 618699
CAS 16634-88-1
Molecular Weight (g/mol) 246.016
MDL Number MFCD00130110
SMILES C1=C(C=C(C(=C1[N+](=O)[O-])O)C=O)Br
Synonym 5-bromo-2-hydroxy-3-nitrobenzaldehyde,5-bromo-3-nitrosalicylaldehyde,benzaldehyde, 5-bromo-2-hydroxy-3-nitro,3-nitro-5-bromosalicylaldehyde,benzaldehyde,5-bromo-2-hydroxy-3-nitro,salicylaldehyde, 5-bromo-3-nitro,acmc-209du3,5-bromo-3-nitrosalicyladehyde,2-hydroxy-3-nitro-5-bromobenzaldehyde
InChI Key YEYPSUQQZNDKDE-UHFFFAOYSA-N
Molecular Formula C7H4BrNO4
4

4-Methoxy-2-nitroaniline, 97%

CAS: 96-96-8 Molecular Formula: C7H8N2O3 Molecular Weight (g/mol): 168.15 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-]

PubChem CID 66793
CAS 96-96-8
Molecular Weight (g/mol) 168.15
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
5

4-Nitroveratrole, 98+%

CAS: 709-09-1 Molecular Formula: C8H9NO4 Molecular Weight (g/mol): 183.16 MDL Number: MFCD00007238 InChI Key: YFWBUVZWCBFSQN-UHFFFAOYSA-N Synonym: 3,4-dimethoxynitrobenzene,4-nitroveratrole,benzene, 1,2-dimethoxy-4-nitro,4-nitrcveratrole,4-nitro-1,2-dimethoxybenzene,benzene,2-dimethoxy-4-nitro,1,2-dimethoxy-4-nitrobenzol,3,4-dimethoxylnitrobenzene,3,4-dimethoxy-1-nitrobenzene PubChem CID: 69728 IUPAC Name: 1,2-dimethoxy-4-nitrobenzene SMILES: COC1=CC=C(C=C1OC)[N+]([O-])=O

PubChem CID 69728
CAS 709-09-1
Molecular Weight (g/mol) 183.16
MDL Number MFCD00007238
SMILES COC1=CC=C(C=C1OC)[N+]([O-])=O
Synonym 3,4-dimethoxynitrobenzene,4-nitroveratrole,benzene, 1,2-dimethoxy-4-nitro,4-nitrcveratrole,4-nitro-1,2-dimethoxybenzene,benzene,2-dimethoxy-4-nitro,1,2-dimethoxy-4-nitrobenzol,3,4-dimethoxylnitrobenzene,3,4-dimethoxy-1-nitrobenzene
IUPAC Name 1,2-dimethoxy-4-nitrobenzene
InChI Key YFWBUVZWCBFSQN-UHFFFAOYSA-N
Molecular Formula C8H9NO4
6

2-Methoxy-4-nitrobenzenesulfonyl chloride, 97%

CAS: 21320-91-2 Molecular Formula: C7H6ClNO5S Molecular Weight (g/mol): 251.64 MDL Number: MFCD03094697 InChI Key: QECYXMKYZQXEHM-UHFFFAOYSA-N Synonym: 2-methoxy-4-nitrobenzene-1-sulfonyl chloride,2-methoxy-4-nitrobenzenesulfonylchloride,benzenesulfonyl chloride, 2-methoxy-4-nitro,pubchem11714,acmc-1ck5c,ksc207c7t,2-chlorosulphonyl-5-nitroanisole,chloro 2-methoxy-4-nitrophenyl sulfone,2-methoxy-4-nitrobenzensulfonyl chloride,2-methoxy-4-nitrophenylsulfonyl chloride PubChem CID: 309458 SMILES: COC1=CC(=CC=C1S(Cl)(=O)=O)[N+]([O-])=O

PubChem CID 309458
CAS 21320-91-2
Molecular Weight (g/mol) 251.64
MDL Number MFCD03094697
SMILES COC1=CC(=CC=C1S(Cl)(=O)=O)[N+]([O-])=O
Synonym 2-methoxy-4-nitrobenzene-1-sulfonyl chloride,2-methoxy-4-nitrobenzenesulfonylchloride,benzenesulfonyl chloride, 2-methoxy-4-nitro,pubchem11714,acmc-1ck5c,ksc207c7t,2-chlorosulphonyl-5-nitroanisole,chloro 2-methoxy-4-nitrophenyl sulfone,2-methoxy-4-nitrobenzensulfonyl chloride,2-methoxy-4-nitrophenylsulfonyl chloride
InChI Key QECYXMKYZQXEHM-UHFFFAOYSA-N
Molecular Formula C7H6ClNO5S
7

2-Fluoro-5-nitrobenzaldehyde, 98%

CAS: 27996-87-8 Molecular Formula: C7H4FNO3 Molecular Weight (g/mol): 169.111 MDL Number: MFCD00042298 InChI Key: VVXFDFQEIRGULC-UHFFFAOYSA-N Synonym: fluoro nitrobenzaldehyde,5-nitro-2-fluorobenzaldehyde,4-fluoro-3-formylnitrobenzene,2-fluoro-5-nitro-benzaldehyde,benzaldehyde, 2-fluoro-5-nitro,pubchem1459,acmc-209h0h,akos bb460,asischem d51510,2-fluoro-5 nitrobenzaldehyde PubChem CID: 2734770 IUPAC Name: 2-fluoro-5-nitrobenzaldehyde SMILES: C1=CC(=C(C=C1[N+](=O)[O-])C=O)F

PubChem CID 2734770
CAS 27996-87-8
Molecular Weight (g/mol) 169.111
MDL Number MFCD00042298
SMILES C1=CC(=C(C=C1[N+](=O)[O-])C=O)F
Synonym fluoro nitrobenzaldehyde,5-nitro-2-fluorobenzaldehyde,4-fluoro-3-formylnitrobenzene,2-fluoro-5-nitro-benzaldehyde,benzaldehyde, 2-fluoro-5-nitro,pubchem1459,acmc-209h0h,akos bb460,asischem d51510,2-fluoro-5 nitrobenzaldehyde
IUPAC Name 2-fluoro-5-nitrobenzaldehyde
InChI Key VVXFDFQEIRGULC-UHFFFAOYSA-N
Molecular Formula C7H4FNO3
8

1,3,5-Trimethoxy-2-nitrobenzene, 98%

CAS: 14227-18-0 Molecular Formula: C9H11NO5 Molecular Weight (g/mol): 213.189 MDL Number: MFCD00016992 InChI Key: VWYAWLZEMLQGJH-UHFFFAOYSA-N PubChem CID: 518903 IUPAC Name: 1,3,5-trimethoxy-2-nitrobenzene SMILES: COC1=CC(=C(C(=C1)OC)[N+](=O)[O-])OC

PubChem CID 518903
CAS 14227-18-0
Molecular Weight (g/mol) 213.189
MDL Number MFCD00016992
SMILES COC1=CC(=C(C(=C1)OC)[N+](=O)[O-])OC
IUPAC Name 1,3,5-trimethoxy-2-nitrobenzene
InChI Key VWYAWLZEMLQGJH-UHFFFAOYSA-N
Molecular Formula C9H11NO5
9

4-Methoxy-2-nitroaniline, 99%

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-]

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
10

3-Bromo-5-nitrobenzaldehyde, 97+%

CAS: 355134-13-3 Molecular Formula: C7H4BrNO3 Molecular Weight (g/mol): 230.017 MDL Number: MFCD00100097 InChI Key: OUDCOMBHRXKPIJ-UHFFFAOYSA-N Synonym: benzaldehyde, 3-bromo-5-nitro,3-bromo-5-nitro-benzaldehyde,3-bromo-5-nitro benzaldehyde,ksc497m5f,3-nitro-5-bromo-benzaldehyde,3-bromanyl-5-nitro-benzaldehyde,5-bromo-3-nitrobenzaldehyde,3-bromo-5-nitrobenzaldehyde PubChem CID: 16743966 IUPAC Name: 3-bromo-5-nitrobenzaldehyde SMILES: C1=C(C=C(C=C1[N+](=O)[O-])Br)C=O

PubChem CID 16743966
CAS 355134-13-3
Molecular Weight (g/mol) 230.017
MDL Number MFCD00100097
SMILES C1=C(C=C(C=C1[N+](=O)[O-])Br)C=O
Synonym benzaldehyde, 3-bromo-5-nitro,3-bromo-5-nitro-benzaldehyde,3-bromo-5-nitro benzaldehyde,ksc497m5f,3-nitro-5-bromo-benzaldehyde,3-bromanyl-5-nitro-benzaldehyde,5-bromo-3-nitrobenzaldehyde,3-bromo-5-nitrobenzaldehyde
IUPAC Name 3-bromo-5-nitrobenzaldehyde
InChI Key OUDCOMBHRXKPIJ-UHFFFAOYSA-N
Molecular Formula C7H4BrNO3
11

4-Nitroanisole, 97%

CAS: 100-17-4 Molecular Formula: C7H7NO3 Molecular Weight (g/mol): 153.14 MDL Number: MFCD00007327 InChI Key: BNUHAJGCKIQFGE-UHFFFAOYSA-N Synonym: 4-nitroanisole,p-nitroanisole,4-methoxynitrobenzene,p-methoxynitrobenzene,benzene, 1-methoxy-4-nitro,nitroanisole,p-nitroanisol,anisole, p-nitro,4-nitrophenyl methyl ether,unii-g989z7wolh PubChem CID: 7485 ChEBI: CHEBI:1911 IUPAC Name: 1-methoxy-4-nitrobenzene SMILES: COC1=CC=C(C=C1)[N+]([O-])=O

PubChem CID 7485
CAS 100-17-4
Molecular Weight (g/mol) 153.14
ChEBI CHEBI:1911
MDL Number MFCD00007327
SMILES COC1=CC=C(C=C1)[N+]([O-])=O
Synonym 4-nitroanisole,p-nitroanisole,4-methoxynitrobenzene,p-methoxynitrobenzene,benzene, 1-methoxy-4-nitro,nitroanisole,p-nitroanisol,anisole, p-nitro,4-nitrophenyl methyl ether,unii-g989z7wolh
IUPAC Name 1-methoxy-4-nitrobenzene
InChI Key BNUHAJGCKIQFGE-UHFFFAOYSA-N
Molecular Formula C7H7NO3
12

4'-Methoxy-2'-nitroacetanilide, 98+%

CAS: 119-81-3 Molecular Formula: C9H10N2O4 Molecular Weight (g/mol): 210.189 MDL Number: MFCD00017018 InChI Key: QGEGALJODPBPGR-UHFFFAOYSA-N Synonym: n-4-methoxy-2-nitrophenyl acetamide,4'-methoxy-2'-nitroacetanilide,4-methoxy-2-nitroacetanilide,2'-nitro-p-acetanisidide,acetamide, n-4-methoxy-2-nitrophenyl,2-nitro-p-acetanisidide,p-acetanisidide, 2-nitro,4-acetamido-3-nitroanisole,2-nitro-4-methoxyacetanilide,p-acetanisidide, 2'-nitro PubChem CID: 67075 IUPAC Name: N-(4-methoxy-2-nitrophenyl)acetamide SMILES: CC(=O)NC1=C(C=C(C=C1)OC)[N+](=O)[O-]

PubChem CID 67075
CAS 119-81-3
Molecular Weight (g/mol) 210.189
MDL Number MFCD00017018
SMILES CC(=O)NC1=C(C=C(C=C1)OC)[N+](=O)[O-]
Synonym n-4-methoxy-2-nitrophenyl acetamide,4'-methoxy-2'-nitroacetanilide,4-methoxy-2-nitroacetanilide,2'-nitro-p-acetanisidide,acetamide, n-4-methoxy-2-nitrophenyl,2-nitro-p-acetanisidide,p-acetanisidide, 2-nitro,4-acetamido-3-nitroanisole,2-nitro-4-methoxyacetanilide,p-acetanisidide, 2'-nitro
IUPAC Name N-(4-methoxy-2-nitrophenyl)acetamide
InChI Key QGEGALJODPBPGR-UHFFFAOYSA-N
Molecular Formula C9H10N2O4
13

4-Bromo-2-fluoro-6-nitroanisole, 97%

CAS: 74266-66-3 Molecular Formula: C7H5BrFNO3 Molecular Weight (g/mol): 250.02 MDL Number: MFCD00013374 InChI Key: CVCAYLYLJKBSNV-UHFFFAOYSA-N Synonym: 4-bromo-2-fluoro-6-nitroanisole,5-bromo-3-fluoro-2-methoxy-1-nitrobenzene,5-bromo-1-fluoro-2-methoxy-3-nitro-benzene,benzene, 5-bromo-1-fluoro-2-methoxy-3-nitro,4-bromo-2-fluoro-6-nitrophenyl methyl ether,timtec-bb sbb005948,acmc-20amnn,pubchem4134,4-bromo-2-fluoro-6-nitroanisol PubChem CID: 557159 IUPAC Name: 5-bromo-1-fluoro-2-methoxy-3-nitrobenzene SMILES: COC1=C(F)C=C(Br)C=C1[N+]([O-])=O

PubChem CID 557159
CAS 74266-66-3
Molecular Weight (g/mol) 250.02
MDL Number MFCD00013374
SMILES COC1=C(F)C=C(Br)C=C1[N+]([O-])=O
Synonym 4-bromo-2-fluoro-6-nitroanisole,5-bromo-3-fluoro-2-methoxy-1-nitrobenzene,5-bromo-1-fluoro-2-methoxy-3-nitro-benzene,benzene, 5-bromo-1-fluoro-2-methoxy-3-nitro,4-bromo-2-fluoro-6-nitrophenyl methyl ether,timtec-bb sbb005948,acmc-20amnn,pubchem4134,4-bromo-2-fluoro-6-nitroanisol
IUPAC Name 5-bromo-1-fluoro-2-methoxy-3-nitrobenzene
InChI Key CVCAYLYLJKBSNV-UHFFFAOYSA-N
Molecular Formula C7H5BrFNO3
14

4-chloro-3-nitrobenzaldehyde, 97%

CAS: 16588-34-4 Molecular Formula: C7H4ClNO3 Molecular Weight (g/mol): 185.56 MDL Number: MFCD00007078 InChI Key: HETBKLHJEWXWBM-UHFFFAOYSA-N Synonym: 3-nitro-4-chlorobenzaldehyde,benzaldehyde, 4-chloro-3-nitro,chembl51664,4-chloro-3-nitro-benzaldehyde,pubchem14274,acmc-1c7bn,3nitro-4-chlorobenzaldehyde,asischem r36965,dsstox_cid_24846,dsstox_rid_80526 PubChem CID: 85505 IUPAC Name: 4-chloro-3-nitrobenzaldehyde SMILES: [O-][N+](=O)C1=CC(C=O)=CC=C1Cl

PubChem CID 85505
CAS 16588-34-4
Molecular Weight (g/mol) 185.56
MDL Number MFCD00007078
SMILES [O-][N+](=O)C1=CC(C=O)=CC=C1Cl
Synonym 3-nitro-4-chlorobenzaldehyde,benzaldehyde, 4-chloro-3-nitro,chembl51664,4-chloro-3-nitro-benzaldehyde,pubchem14274,acmc-1c7bn,3nitro-4-chlorobenzaldehyde,asischem r36965,dsstox_cid_24846,dsstox_rid_80526
IUPAC Name 4-chloro-3-nitrobenzaldehyde
InChI Key HETBKLHJEWXWBM-UHFFFAOYSA-N
Molecular Formula C7H4ClNO3
15

1-(2-bromoethoxy)-4-nitrobenzene, 98%

CAS: 13288-06-7 Molecular Formula: C8H8BrNO3 Molecular Weight (g/mol): 246.06 MDL Number: MFCD00031363 InChI Key: YQWCBDNNEZHPMA-UHFFFAOYSA-N Synonym: 1-2-bromoethoxy-4-nitrobenzene,2-bromoethyl 4-nitrophenyl ether,beta-bromo-4-nitrophenetole,2-4-nitrophenoxy ethyl bromide,4-2-bromoethoxy-1-nitrobenzene,1-2-bromoethyloxy-4-nitro-benzene,benzene, 1-2-bromoethoxy-4-nitro,4-2-bromoethoxy nitrobenzene,acmc-1azdi PubChem CID: 235987 IUPAC Name: 1-(2-bromoethoxy)-4-nitrobenzene SMILES: [O-][N+](=O)C1=CC=C(OCCBr)C=C1

PubChem CID 235987
CAS 13288-06-7
Molecular Weight (g/mol) 246.06
MDL Number MFCD00031363
SMILES [O-][N+](=O)C1=CC=C(OCCBr)C=C1
Synonym 1-2-bromoethoxy-4-nitrobenzene,2-bromoethyl 4-nitrophenyl ether,beta-bromo-4-nitrophenetole,2-4-nitrophenoxy ethyl bromide,4-2-bromoethoxy-1-nitrobenzene,1-2-bromoethyloxy-4-nitro-benzene,benzene, 1-2-bromoethoxy-4-nitro,4-2-bromoethoxy nitrobenzene,acmc-1azdi
IUPAC Name 1-(2-bromoethoxy)-4-nitrobenzene
InChI Key YQWCBDNNEZHPMA-UHFFFAOYSA-N
Molecular Formula C8H8BrNO3