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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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Keyword Search:
1 – 15 of 80 results
1

2-Hydroxy-3-methoxy-5-nitrobenzaldehyde, 98%

CAS: 17028-61-4 Molecular Formula: C8H7NO5 Molecular Weight (g/mol): 197.15 MDL Number: MFCD00017033 InChI Key: HGKHVFKBOHFYSS-UHFFFAOYSA-N PubChem CID: 307886 IUPAC Name: 2-hydroxy-3-methoxy-5-nitrobenzaldehyde SMILES: COC1=CC(=CC(C=O)=C1O)[N+]([O-])=O

PubChem CID 307886
CAS 17028-61-4
Molecular Weight (g/mol) 197.15
MDL Number MFCD00017033
SMILES COC1=CC(=CC(C=O)=C1O)[N+]([O-])=O
IUPAC Name 2-hydroxy-3-methoxy-5-nitrobenzaldehyde
InChI Key HGKHVFKBOHFYSS-UHFFFAOYSA-N
Molecular Formula C8H7NO5
2

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
3

2-Chloro-5-nitrobenzaldehyde, 97%

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

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
4

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
5

N-(3-Hydroxyphenyl)thiourea, 97%

CAS: 3394-05-6 MDL Number: MFCD00022167

CAS 3394-05-6
MDL Number MFCD00022167
6

4,5-Dimethoxy-2-nitrobenzyl chloroformate, 97%

CAS: 42855-00-5 Molecular Formula: C10H10ClNO6 Molecular Weight (g/mol): 275.641 MDL Number: MFCD00143507 InChI Key: RWWPKIOWBQFXEE-UHFFFAOYSA-N Synonym: 4,5-dimethoxy-2-nitrobenzyl carbonochloridate,nvoc-cl,4,5-dimethoxy-2-nitrobenzyl chloroformate,6-nitroveratryl chloroformate,nitroveratryl oxy chlorocarbamate,6-nitroveratryloxycarbonyl chloride,carbonochloridic acid, 4,5-dimethoxy-2-nitrophenyl methyl ester,4,5-dimethoxy-2-nitrophenyl methyl chloroformate,4,5-dimethoxy-2-nitrophenyl methyl carbonochloridate,nvoc chloride PubChem CID: 3084878 IUPAC Name: (4,5-dimethoxy-2-nitrophenyl)methyl carbonochloridate SMILES: COC1=C(C=C(C(=C1)COC(=O)Cl)[N+](=O)[O-])OC

PubChem CID 3084878
CAS 42855-00-5
Molecular Weight (g/mol) 275.641
MDL Number MFCD00143507
SMILES COC1=C(C=C(C(=C1)COC(=O)Cl)[N+](=O)[O-])OC
Synonym 4,5-dimethoxy-2-nitrobenzyl carbonochloridate,nvoc-cl,4,5-dimethoxy-2-nitrobenzyl chloroformate,6-nitroveratryl chloroformate,nitroveratryl oxy chlorocarbamate,6-nitroveratryloxycarbonyl chloride,carbonochloridic acid, 4,5-dimethoxy-2-nitrophenyl methyl ester,4,5-dimethoxy-2-nitrophenyl methyl chloroformate,4,5-dimethoxy-2-nitrophenyl methyl carbonochloridate,nvoc chloride
IUPAC Name (4,5-dimethoxy-2-nitrophenyl)methyl carbonochloridate
InChI Key RWWPKIOWBQFXEE-UHFFFAOYSA-N
Molecular Formula C10H10ClNO6
7

2-Nitroanisole, 99%

CAS: 91-23-6 Molecular Formula: C7H7NO3 Molecular Weight (g/mol): 153.14 MDL Number: MFCD00007096 InChI Key: CFBYEGUGFPZCNF-UHFFFAOYSA-N Synonym: 2-nitroanisole,o-nitroanisole,anisole, o-nitro,1-nitro-2-methoxybenzene,2-methoxynitrobenzene,o-nitrophenyl methyl ether,benzene, 1-methoxy-2-nitro,2-methoxy-1-nitrobenzene,benzene, methoxynitro,o-nitro methoxy benzene PubChem CID: 7048 ChEBI: CHEBI:48722 IUPAC Name: 1-methoxy-2-nitrobenzene SMILES: COC1=CC=CC=C1[N+]([O-])=O

PubChem CID 7048
CAS 91-23-6
Molecular Weight (g/mol) 153.14
ChEBI CHEBI:48722
MDL Number MFCD00007096
SMILES COC1=CC=CC=C1[N+]([O-])=O
Synonym 2-nitroanisole,o-nitroanisole,anisole, o-nitro,1-nitro-2-methoxybenzene,2-methoxynitrobenzene,o-nitrophenyl methyl ether,benzene, 1-methoxy-2-nitro,2-methoxy-1-nitrobenzene,benzene, methoxynitro,o-nitro methoxy benzene
IUPAC Name 1-methoxy-2-nitrobenzene
InChI Key CFBYEGUGFPZCNF-UHFFFAOYSA-N
Molecular Formula C7H7NO3
8

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
9

2-Hydroxy-5-nitrobenzaldehyde, 98%

CAS: 97-51-8 Molecular Formula: C7H5NO4 Molecular Weight (g/mol): 167.12 MDL Number: MFCD00007337 InChI Key: IHFRMUGEILMHNU-UHFFFAOYSA-N Synonym: 5-nitrosalicylaldehyde,benzaldehyde, 2-hydroxy-5-nitro,salicylaldehyde, 5-nitro,5-nitrosaliclaldehyde,2-hydroxy-5-nitro-benzaldehyde,5-nitro salicylaldehdye,timtec-bb sbb003885,labotest-bb lt00920994,salicylaldehyde, 5-nitro-6ci,7ci,8ci,pubchem2052 PubChem CID: 66808 IUPAC Name: 2-hydroxy-5-nitrobenzaldehyde SMILES: OC1=CC=C(C=C1C=O)[N+]([O-])=O

PubChem CID 66808
CAS 97-51-8
Molecular Weight (g/mol) 167.12
MDL Number MFCD00007337
SMILES OC1=CC=C(C=C1C=O)[N+]([O-])=O
Synonym 5-nitrosalicylaldehyde,benzaldehyde, 2-hydroxy-5-nitro,salicylaldehyde, 5-nitro,5-nitrosaliclaldehyde,2-hydroxy-5-nitro-benzaldehyde,5-nitro salicylaldehdye,timtec-bb sbb003885,labotest-bb lt00920994,salicylaldehyde, 5-nitro-6ci,7ci,8ci,pubchem2052
IUPAC Name 2-hydroxy-5-nitrobenzaldehyde
InChI Key IHFRMUGEILMHNU-UHFFFAOYSA-N
Molecular Formula C7H5NO4
10

4,5-Dimethoxy-2-nitrobenzyl alcohol, 98%

CAS: 1016-58-6 Molecular Formula: C9H11NO5 Molecular Weight (g/mol): 213.189 MDL Number: MFCD00014701 InChI Key: WBSCOJBVYHQOFB-UHFFFAOYSA-N Synonym: 4,5-dimethoxy-2-nitrobenzyl alcohol,6-nitroveratryl alcohol,4,5-dimethoxy-2-nitrophenyl methanol,benzenemethanol, 4,5-dimethoxy-2-nitro,2-nitro-4,5-dimethoxybenzyl alcohol,3,4-dimethoxy-6-nitrobenzyl alcohol,4,5-dimethoxy-2-nitrophenyl methan-1-ol,6-nitroveratrylalcohol,pubchem8715,4,5-dimethoxy 2-nitrobenzyl alcohol PubChem CID: 66097 IUPAC Name: (4,5-dimethoxy-2-nitrophenyl)methanol SMILES: COC1=C(C=C(C(=C1)CO)[N+](=O)[O-])OC

PubChem CID 66097
CAS 1016-58-6
Molecular Weight (g/mol) 213.189
MDL Number MFCD00014701
SMILES COC1=C(C=C(C(=C1)CO)[N+](=O)[O-])OC
Synonym 4,5-dimethoxy-2-nitrobenzyl alcohol,6-nitroveratryl alcohol,4,5-dimethoxy-2-nitrophenyl methanol,benzenemethanol, 4,5-dimethoxy-2-nitro,2-nitro-4,5-dimethoxybenzyl alcohol,3,4-dimethoxy-6-nitrobenzyl alcohol,4,5-dimethoxy-2-nitrophenyl methan-1-ol,6-nitroveratrylalcohol,pubchem8715,4,5-dimethoxy 2-nitrobenzyl alcohol
IUPAC Name (4,5-dimethoxy-2-nitrophenyl)methanol
InChI Key WBSCOJBVYHQOFB-UHFFFAOYSA-N
Molecular Formula C9H11NO5
11

1-Nitro-2-(n-octyloxy)benzene, 98%

CAS: 37682-29-4 Molecular Formula: C14H21NO3 Molecular Weight (g/mol): 251.326 MDL Number: MFCD00014693 InChI Key: CXVOIIMJZFREMM-UHFFFAOYSA-N Synonym: 2-nitrophenyl octyl ether,1-nitro-2-octyloxy benzene,octyl o-nitrophenyl ether,2-nitrophenyl n-octyl ether,2-octyloxy nitrobenzene,benzene, 1-nitro-2-octyloxy,1-2-nitrophenoxy octane,1-nitro-2-octyloxybenzene,2-n-octyloxy nitrobenzene,npoe PubChem CID: 169952 IUPAC Name: 1-nitro-2-octoxybenzene SMILES: CCCCCCCCOC1=CC=CC=C1[N+](=O)[O-]

PubChem CID 169952
CAS 37682-29-4
Molecular Weight (g/mol) 251.326
MDL Number MFCD00014693
SMILES CCCCCCCCOC1=CC=CC=C1[N+](=O)[O-]
Synonym 2-nitrophenyl octyl ether,1-nitro-2-octyloxy benzene,octyl o-nitrophenyl ether,2-nitrophenyl n-octyl ether,2-octyloxy nitrobenzene,benzene, 1-nitro-2-octyloxy,1-2-nitrophenoxy octane,1-nitro-2-octyloxybenzene,2-n-octyloxy nitrobenzene,npoe
IUPAC Name 1-nitro-2-octoxybenzene
InChI Key CXVOIIMJZFREMM-UHFFFAOYSA-N
Molecular Formula C14H21NO3
12

1-Difluoromethoxy-3-nitrobenzene, 98%, Thermo Scientific Chemicals

CAS: 22236-07-3 Molecular Formula: C7H5F2NO3 Molecular Weight (g/mol): 189.12 MDL Number: MFCD03407974 InChI Key: NYVCZALWNPMMSQ-UHFFFAOYSA-N Synonym: 1-difluoromethoxy-3-nitrobenzene,3-difluoromethoxy nitrobenzene,benzene, 1-difluoromethoxy-3-nitro,acmc-1coex,nyvczalwnpmmsq-uhfffaoysa,difluoromethyl 3-nitrophenyl ether,3-difluoromethoxy-1-nitrobenzene,3-nitro-1-difluoromethoxy benzene,3-nitro-alpha,alpha-difluoroanisole,alpha,alpha-difluoro-3-nitroanisole PubChem CID: 2774117 IUPAC Name: 1-(difluoromethoxy)-3-nitrobenzene SMILES: [O-][N+](=O)C1=CC=CC(OC(F)F)=C1

PubChem CID 2774117
CAS 22236-07-3
Molecular Weight (g/mol) 189.12
MDL Number MFCD03407974
SMILES [O-][N+](=O)C1=CC=CC(OC(F)F)=C1
Synonym 1-difluoromethoxy-3-nitrobenzene,3-difluoromethoxy nitrobenzene,benzene, 1-difluoromethoxy-3-nitro,acmc-1coex,nyvczalwnpmmsq-uhfffaoysa,difluoromethyl 3-nitrophenyl ether,3-difluoromethoxy-1-nitrobenzene,3-nitro-1-difluoromethoxy benzene,3-nitro-alpha,alpha-difluoroanisole,alpha,alpha-difluoro-3-nitroanisole
IUPAC Name 1-(difluoromethoxy)-3-nitrobenzene
InChI Key NYVCZALWNPMMSQ-UHFFFAOYSA-N
Molecular Formula C7H5F2NO3
13

4-Methyl-3-nitrobenzaldehyde, 98%

CAS: 31680-07-6 Molecular Formula: C8H7NO3 Molecular Weight (g/mol): 165.15 MDL Number: MFCD00017011 InChI Key: KHWGAWBXQOKXIJ-UHFFFAOYSA-N Synonym: 3-nitro-p-tolualdehyde,4-methyl-3-nitro-benzaldehyde,3-nitro-4-methylbenzaldehyde,benzaldehyde, 4-methyl-3-nitro,methylnitrobenzaldehyde,pubchem8157,acmc-209hod,4-methyl-3-nitrobenzaldehyde PubChem CID: 1798998 IUPAC Name: 4-methyl-3-nitrobenzaldehyde SMILES: CC1=CC=C(C=O)C=C1[N+]([O-])=O

PubChem CID 1798998
CAS 31680-07-6
Molecular Weight (g/mol) 165.15
MDL Number MFCD00017011
SMILES CC1=CC=C(C=O)C=C1[N+]([O-])=O
Synonym 3-nitro-p-tolualdehyde,4-methyl-3-nitro-benzaldehyde,3-nitro-4-methylbenzaldehyde,benzaldehyde, 4-methyl-3-nitro,methylnitrobenzaldehyde,pubchem8157,acmc-209hod,4-methyl-3-nitrobenzaldehyde
IUPAC Name 4-methyl-3-nitrobenzaldehyde
InChI Key KHWGAWBXQOKXIJ-UHFFFAOYSA-N
Molecular Formula C8H7NO3
14

4-Nitrobenzaldehyde, 99%

CAS: 555-16-8 Molecular Formula: C7H5NO3 Molecular Weight (g/mol): 151.12 MDL Number: MFCD00007346 InChI Key: BXRFQSNOROATLV-UHFFFAOYSA-N Synonym: p-nitrobenzaldehyde,benzaldehyde, 4-nitro,p-formylnitrobenzene,benzaldehyde, p-nitro,4-nitrobenzaldehydde,4-nitro-benzaldehyde,4-formylnitrobenzene,p-nitro benzaldehyde,4-nitro benzaldehyde,ccris 1675 PubChem CID: 541 ChEBI: CHEBI:66926 IUPAC Name: 4-nitrobenzaldehyde SMILES: [O-][N+](=O)C1=CC=C(C=O)C=C1

PubChem CID 541
CAS 555-16-8
Molecular Weight (g/mol) 151.12
ChEBI CHEBI:66926
MDL Number MFCD00007346
SMILES [O-][N+](=O)C1=CC=C(C=O)C=C1
Synonym p-nitrobenzaldehyde,benzaldehyde, 4-nitro,p-formylnitrobenzene,benzaldehyde, p-nitro,4-nitrobenzaldehydde,4-nitro-benzaldehyde,4-formylnitrobenzene,p-nitro benzaldehyde,4-nitro benzaldehyde,ccris 1675
IUPAC Name 4-nitrobenzaldehyde
InChI Key BXRFQSNOROATLV-UHFFFAOYSA-N
Molecular Formula C7H5NO3
15

2-Methoxy-6-nitroaniline, 97%, Thermo Scientific™

CAS: 16554-45-3 Molecular Formula: C7H8N2O3 Molecular Weight (g/mol): 168.152 MDL Number: MFCD01930197 InChI Key: NDKWDGCTUOOAPF-UHFFFAOYSA-N Synonym: 2-methoxy-6-nitrophenylamine,2-amino-3-nitroanisole,2-methoxy-6-nitro-phenylamine,6-nitro-o-anisidine,2-methoxy-6-nitrobenzenamine,6-methoxy-2-nitroaniline,2-amino-3-methoxynitrobenzene,benzenamine, 2-methoxy-6-nitro,ambkkkkk250,pubchem19661 PubChem CID: 85491 IUPAC Name: 2-methoxy-6-nitroaniline SMILES: COC1=CC=CC(=C1N)[N+](=O)[O-]

PubChem CID 85491
CAS 16554-45-3
Molecular Weight (g/mol) 168.152
MDL Number MFCD01930197
SMILES COC1=CC=CC(=C1N)[N+](=O)[O-]
Synonym 2-methoxy-6-nitrophenylamine,2-amino-3-nitroanisole,2-methoxy-6-nitro-phenylamine,6-nitro-o-anisidine,2-methoxy-6-nitrobenzenamine,6-methoxy-2-nitroaniline,2-amino-3-methoxynitrobenzene,benzenamine, 2-methoxy-6-nitro,ambkkkkk250,pubchem19661
IUPAC Name 2-methoxy-6-nitroaniline
InChI Key NDKWDGCTUOOAPF-UHFFFAOYSA-N
Molecular Formula C7H8N2O3