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.

1 – 15 of 114 results

2-Nitrobenzaldehyde, 99+%, Thermo Scientific Chemicals

CAS: 552-89-6 Molecular Formula: C₇H₅NO₃ Molecular Weight (g/mol): 151.12 InChI Key: CMWKITSNTDAEDT-UHFFFAOYSA-N Synonym: o-nitrobenzaldehyde,benzaldehyde, 2-nitro,nitrobenzaldehyde,benzaldehyde, o-nitro,2-nitro-benzaldehyde,2-formylnitrobenzene,ccris 2322,unii-48b18q9b8e,benzaldehyde, nitro,ortho-nitrobenzaldehyde PubChem CID: 11101 ChEBI: CHEBI:66927 IUPAC Name: 2-nitrobenzaldehyde SMILES: C1=CC=C(C(=C1)C=O)[N+](=O)[O-]

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Specifications

PubChem CID	11101
CAS	552-89-6
Molecular Weight (g/mol)	151.12
ChEBI	CHEBI:66927
SMILES	C1=CC=C(C(=C1)C=O)[N+](=O)[O-]
Synonym	o-nitrobenzaldehyde,benzaldehyde, 2-nitro,nitrobenzaldehyde,benzaldehyde, o-nitro,2-nitro-benzaldehyde,2-formylnitrobenzene,ccris 2322,unii-48b18q9b8e,benzaldehyde, nitro,ortho-nitrobenzaldehyde
IUPAC Name	2-nitrobenzaldehyde
InChI Key	CMWKITSNTDAEDT-UHFFFAOYSA-N
Molecular Formula	C₇H₅NO₃

2-Nitrobenzaldehyde, 97%, Thermo Scientific™

CAS: 552-89-6 Molecular Formula: C7H5NO3 Molecular Weight (g/mol): 151.121 MDL Number: MFCD00007132 InChI Key: CMWKITSNTDAEDT-UHFFFAOYSA-N Synonym: o-nitrobenzaldehyde,benzaldehyde, 2-nitro,nitrobenzaldehyde,benzaldehyde, o-nitro,2-nitro-benzaldehyde,2-formylnitrobenzene,ccris 2322,unii-48b18q9b8e,benzaldehyde, nitro,ortho-nitrobenzaldehyde PubChem CID: 11101 ChEBI: CHEBI:66927 IUPAC Name: 2-nitrobenzaldehyde SMILES: C1=CC=C(C(=C1)C=O)[N+](=O)[O-]

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Specifications

PubChem CID	11101
CAS	552-89-6
Molecular Weight (g/mol)	151.121
ChEBI	CHEBI:66927
MDL Number	MFCD00007132
SMILES	C1=CC=C(C(=C1)C=O)[N+](=O)[O-]
Synonym	o-nitrobenzaldehyde,benzaldehyde, 2-nitro,nitrobenzaldehyde,benzaldehyde, o-nitro,2-nitro-benzaldehyde,2-formylnitrobenzene,ccris 2322,unii-48b18q9b8e,benzaldehyde, nitro,ortho-nitrobenzaldehyde
IUPAC Name	2-nitrobenzaldehyde
InChI Key	CMWKITSNTDAEDT-UHFFFAOYSA-N
Molecular Formula	C7H5NO3

3-bromo-2-hydroxy-5-nitrobenzaldehyde, Thermo Scientific™

CAS: 16789-84-7 Molecular Formula: C7H4BrNO4 Molecular Weight (g/mol): 246.02 MDL Number: MFCD00051833 InChI Key: BESBCGANGAEHPM-UHFFFAOYSA-N Synonym: 3-bromo-2-hydroxy-5-nitrobenzaldehyde,3-bromo-5-nitrosalicylaldehyde,3-bromo-2-hydroxy-5-nitrobenzenecarbaldehyde,2-hydroxy-3-bromo-5-nitrobenzaldehyde,3-bromo-2-hydroxy-5-nitro-benzaldehyde,acmc-1cfaz,3-bromo-5-nitro-salicylaldehyde,benzaldehyde,3-bromo-2-hydroxy-5-nitro,3-bromanyl-5-nitro-2-oxidanyl-benzaldehyde PubChem CID: 519307 IUPAC Name: 3-bromo-2-hydroxy-5-nitrobenzaldehyde SMILES: OC1=C(Br)C=C(C=C1C=O)[N+]([O-])=O

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Specifications

PubChem CID	519307
CAS	16789-84-7
Molecular Weight (g/mol)	246.02
MDL Number	MFCD00051833
SMILES	OC1=C(Br)C=C(C=C1C=O)[N+]([O-])=O
Synonym	3-bromo-2-hydroxy-5-nitrobenzaldehyde,3-bromo-5-nitrosalicylaldehyde,3-bromo-2-hydroxy-5-nitrobenzenecarbaldehyde,2-hydroxy-3-bromo-5-nitrobenzaldehyde,3-bromo-2-hydroxy-5-nitro-benzaldehyde,acmc-1cfaz,3-bromo-5-nitro-salicylaldehyde,benzaldehyde,3-bromo-2-hydroxy-5-nitro,3-bromanyl-5-nitro-2-oxidanyl-benzaldehyde
IUPAC Name	3-bromo-2-hydroxy-5-nitrobenzaldehyde
InChI Key	BESBCGANGAEHPM-UHFFFAOYSA-N
Molecular Formula	C7H4BrNO4

4-Nitrobenzaldehyde, 99%, Thermo Scientific Chemicals

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

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Specifications

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

2-Methoxy-4-nitroaniline, 99%, Thermo Scientific Chemicals

CAS: 97-52-9 Molecular Formula: C7H8N2O3 Molecular Weight (g/mol): 168.15 MDL Number: MFCD00007363 InChI Key: GVBHRNIWBGTNQA-UHFFFAOYSA-N Synonym: fast red b base,benzenamine, 2-methoxy-4-nitro,4-nitro-o-anisidine,fast red base b,fast red b,red b base,diazo fast red b,2-amino-5-nitroanisole,azoamine pink o,fast red 5na base PubChem CID: 7337 IUPAC Name: 2-methoxy-4-nitroaniline SMILES: COC1=CC(=CC=C1N)[N+]([O-])=O

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Specifications

PubChem CID	7337
CAS	97-52-9
Molecular Weight (g/mol)	168.15
MDL Number	MFCD00007363
SMILES	COC1=CC(=CC=C1N)[N+]([O-])=O
Synonym	fast red b base,benzenamine, 2-methoxy-4-nitro,4-nitro-o-anisidine,fast red base b,fast red b,red b base,diazo fast red b,2-amino-5-nitroanisole,azoamine pink o,fast red 5na base
IUPAC Name	2-methoxy-4-nitroaniline
InChI Key	GVBHRNIWBGTNQA-UHFFFAOYSA-N
Molecular Formula	C7H8N2O3

5-Methoxy-2-nitroaniline, 98%, Thermo Scientific Chemicals

CAS: 16133-49-6 Molecular Formula: C7H8N2O3 Molecular Weight (g/mol): 168.152 MDL Number: MFCD00179573 InChI Key: QEHVRGACCVLLNN-UHFFFAOYSA-N Synonym: 5-methoxy-2-nitrophenylamine,3-amino-4-nitroanisole,5methoxy-2-nitroaniline,5-methoxy-2-nitrobenzenamine,3-amino-4-nitro-anisol,2-nitro-5-methoxyaniline,5-methoxy-2-nitro-aniline,benzenamine, 5-methoxy-2-nitro,benzenamine,5-methoxy-2-nitro,5-methoxy-2-nitro-phenylamine PubChem CID: 85300 IUPAC Name: 5-methoxy-2-nitroaniline SMILES: COC1=CC(=C(C=C1)[N+](=O)[O-])N

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Specifications

PubChem CID	85300
CAS	16133-49-6
Molecular Weight (g/mol)	168.152
MDL Number	MFCD00179573
SMILES	COC1=CC(=C(C=C1)[N+](=O)[O-])N
Synonym	5-methoxy-2-nitrophenylamine,3-amino-4-nitroanisole,5methoxy-2-nitroaniline,5-methoxy-2-nitrobenzenamine,3-amino-4-nitro-anisol,2-nitro-5-methoxyaniline,5-methoxy-2-nitro-aniline,benzenamine, 5-methoxy-2-nitro,benzenamine,5-methoxy-2-nitro,5-methoxy-2-nitro-phenylamine
IUPAC Name	5-methoxy-2-nitroaniline
InChI Key	QEHVRGACCVLLNN-UHFFFAOYSA-N
Molecular Formula	C7H8N2O3

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

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-]

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Specifications

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

6-Nitroveratraldehyde, 96%, Thermo Scientific Chemicals

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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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

1,2-Dimethoxy-4,5-dinitrobenzene, 96%, Thermo Scientific Chemicals

CAS: 3395-03-7 MDL Number: MFCD00082695

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Specifications

CAS	3395-03-7
MDL Number	MFCD00082695

4-chloro-3-nitrobenzaldehyde, 97%, Thermo Scientific Chemicals

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

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Specifications

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

2-Hydroxy-3-nitrobenzaldehyde, 98%, Thermo Scientific Chemicals

CAS: 5274-70-4 Molecular Formula: C7H5NO4 Molecular Weight (g/mol): 167.12 MDL Number: MFCD00041874 InChI Key: NUGOTBXFVWXVTE-UHFFFAOYSA-N Synonym: 3-nitrosalicylaldehyde,salicylaldehyde, 3-nitro,benzaldehyde, 2-hydroxy-3-nitro,3-nitro-2-hydroxybenzaldehyde,3-nitrosalicaldehyde,pubchem7773,2-hydroxy-nitrobenzaldehyde,acmc-209l1g,3-nitrosalicylaidehyde,benzaldehyde, 2-hydroxynitro PubChem CID: 78934 IUPAC Name: 2-hydroxy-3-nitrobenzaldehyde SMILES: C1=CC(=C(C(=C1)[N+](=O)[O-])O)C=O

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Specifications

PubChem CID	78934
CAS	5274-70-4
Molecular Weight (g/mol)	167.12
MDL Number	MFCD00041874
SMILES	C1=CC(=C(C(=C1)[N+](=O)[O-])O)C=O
Synonym	3-nitrosalicylaldehyde,salicylaldehyde, 3-nitro,benzaldehyde, 2-hydroxy-3-nitro,3-nitro-2-hydroxybenzaldehyde,3-nitrosalicaldehyde,pubchem7773,2-hydroxy-nitrobenzaldehyde,acmc-209l1g,3-nitrosalicylaidehyde,benzaldehyde, 2-hydroxynitro
IUPAC Name	2-hydroxy-3-nitrobenzaldehyde
InChI Key	NUGOTBXFVWXVTE-UHFFFAOYSA-N
Molecular Formula	C7H5NO4

3-Iodo-4-nitroanisole, 97%, Thermo Scientific Chemicals

CAS: 214279-40-0 Molecular Formula: C7H6INO3 Molecular Weight (g/mol): 279.03 MDL Number: MFCD01320682 InChI Key: NLTAHTYBZZSCIT-UHFFFAOYSA-N Synonym: 3-iodo-4-nitroanisole,4-nitro-3-iodoanisole,benzene, 2-iodo-4-methoxy-1-nitro,1-nitro-2-iodo-4-methoxybenzene,3-iodo-4-nitrophenyl methyl ether,benzene,2-iodo-4-methoxy-1-nitro PubChem CID: 2733456 IUPAC Name: 2-iodo-4-methoxy-1-nitrobenzene SMILES: COC1=CC=C(C(I)=C1)[N+]([O-])=O

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Specifications

PubChem CID	2733456
CAS	214279-40-0
Molecular Weight (g/mol)	279.03
MDL Number	MFCD01320682
SMILES	COC1=CC=C(C(I)=C1)[N+]([O-])=O
Synonym	3-iodo-4-nitroanisole,4-nitro-3-iodoanisole,benzene, 2-iodo-4-methoxy-1-nitro,1-nitro-2-iodo-4-methoxybenzene,3-iodo-4-nitrophenyl methyl ether,benzene,2-iodo-4-methoxy-1-nitro
IUPAC Name	2-iodo-4-methoxy-1-nitrobenzene
InChI Key	NLTAHTYBZZSCIT-UHFFFAOYSA-N
Molecular Formula	C7H6INO3

2-Chloro-6-nitrobenzaldehyde, 98%, Thermo Scientific Chemicals

CAS: 6361-22-4 Molecular Formula: C7H4ClNO3 Molecular Weight (g/mol): 185.56 MDL Number: MFCD00007204 InChI Key: RZDOUWDCYULHJX-UHFFFAOYSA-N PubChem CID: 80701 IUPAC Name: 2-chloro-6-nitrobenzaldehyde SMILES: [O-][N+](=O)C1=CC=CC(Cl)=C1C=O

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Specifications

PubChem CID	80701
CAS	6361-22-4
Molecular Weight (g/mol)	185.56
MDL Number	MFCD00007204
SMILES	[O-][N+](=O)C1=CC=CC(Cl)=C1C=O
IUPAC Name	2-chloro-6-nitrobenzaldehyde
InChI Key	RZDOUWDCYULHJX-UHFFFAOYSA-N
Molecular Formula	C7H4ClNO3

2-Hydroxy-3-methoxy-5-nitrobenzaldehyde, 98%, Thermo Scientific Chemicals

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

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Specifications

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

5-Nitrovanillin, 97%, Thermo Scientific Chemicals

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

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Specifications

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

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