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 348 results

2-Nitrobenzaldehyde, 99+%

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

4-Iodo-3-nitroanisole, 98+%

CAS: 58755-70-7 Molecular Formula: C7H6INO3 Molecular Weight (g/mol): 279.033 MDL Number: MFCD00024195 InChI Key: JWZODIRSJJQOKY-UHFFFAOYSA-N Synonym: 4-iodo-3-nitroanisole,3-nitro-4-iodoanisole,2-iodo-5-methoxynitrobenzene,1-iodo-4-methoxy-2-nitro-benzene,benzene, 1-iodo-4-methoxy-2-nitro,3-nitro-4-iodoanisol,acmc-1b13g,ksc494s9p,1-iodo-2-nitro-4-methoxybenzene,attercop-chm at115569 PubChem CID: 292659 IUPAC Name: 1-iodo-4-methoxy-2-nitrobenzene SMILES: COC1=CC(=C(C=C1)I)[N+](=O)[O-]

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Specifications

PubChem CID	292659
CAS	58755-70-7
Molecular Weight (g/mol)	279.033
MDL Number	MFCD00024195
SMILES	COC1=CC(=C(C=C1)I)[N+](=O)[O-]
Synonym	4-iodo-3-nitroanisole,3-nitro-4-iodoanisole,2-iodo-5-methoxynitrobenzene,1-iodo-4-methoxy-2-nitro-benzene,benzene, 1-iodo-4-methoxy-2-nitro,3-nitro-4-iodoanisol,acmc-1b13g,ksc494s9p,1-iodo-2-nitro-4-methoxybenzene,attercop-chm at115569
IUPAC Name	1-iodo-4-methoxy-2-nitrobenzene
InChI Key	JWZODIRSJJQOKY-UHFFFAOYSA-N
Molecular Formula	C7H6INO3

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

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Specifications

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

4-Iodo-2-nitroanisole, 98%

CAS: 52692-09-8 Molecular Formula: C7H6INO3 Molecular Weight (g/mol): 279.033 MDL Number: MFCD08060933 InChI Key: WULXGCDMVLQZBT-UHFFFAOYSA-N Synonym: 4-iodo-2-nitroanisole,4-iodo-1-methoxy-2-nitro-benzene,benzene, 4-iodo-1-methoxy-2-nitro,2-nitro-4-iodoanisole,acmc-1amtn,4-methoxy-3-nitroiodobenzene,benzene,4-iodo-1-methoxy-2-nitro,4-iodanyl-1-methoxy-2-nitro-benzene PubChem CID: 12249866 IUPAC Name: 4-iodo-1-methoxy-2-nitrobenzene SMILES: COC1=C(C=C(C=C1)I)[N+](=O)[O-]

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Specifications

PubChem CID	12249866
CAS	52692-09-8
Molecular Weight (g/mol)	279.033
MDL Number	MFCD08060933
SMILES	COC1=C(C=C(C=C1)I)[N+](=O)[O-]
Synonym	4-iodo-2-nitroanisole,4-iodo-1-methoxy-2-nitro-benzene,benzene, 4-iodo-1-methoxy-2-nitro,2-nitro-4-iodoanisole,acmc-1amtn,4-methoxy-3-nitroiodobenzene,benzene,4-iodo-1-methoxy-2-nitro,4-iodanyl-1-methoxy-2-nitro-benzene
IUPAC Name	4-iodo-1-methoxy-2-nitrobenzene
InChI Key	WULXGCDMVLQZBT-UHFFFAOYSA-N
Molecular Formula	C7H6INO3

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

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Specifications

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

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

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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

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

3-Nitrobenzaldehyde, 99%

CAS: 99-61-6 Molecular Formula: C7H5NO3 MDL Number: MFCD00007249 InChI Key: ZETIVVHRRQLWFW-UHFFFAOYSA-N Synonym: m-nitrobenzaldehyde,benzaldehyde, 3-nitro,3-formylnitrobenzene,meta-nitrobenzaldehyde,benzaldehyde, m-nitro,5-nitrobenzaldehyde,unii-g4o92ko71z,3-nitro-benzaldehyde,ccris 1784,m-nitro-benzaldehyde PubChem CID: 7449 IUPAC Name: 3-nitrobenzaldehyde

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Specifications

PubChem CID	7449
CAS	99-61-6
MDL Number	MFCD00007249
Synonym	m-nitrobenzaldehyde,benzaldehyde, 3-nitro,3-formylnitrobenzene,meta-nitrobenzaldehyde,benzaldehyde, m-nitro,5-nitrobenzaldehyde,unii-g4o92ko71z,3-nitro-benzaldehyde,ccris 1784,m-nitro-benzaldehyde
IUPAC Name	3-nitrobenzaldehyde
InChI Key	ZETIVVHRRQLWFW-UHFFFAOYSA-N
Molecular Formula	C7H5NO3

3-Nitrobenzaldehyde, 99%

CAS: 99-61-6 Molecular Formula: C₇H₅NO₃ Molecular Weight (g/mol): 151.12 MDL Number: MFCD00007249 InChI Key: ZETIVVHRRQLWFW-UHFFFAOYSA-N Synonym: m-nitrobenzaldehyde,benzaldehyde, 3-nitro,3-formylnitrobenzene,meta-nitrobenzaldehyde,benzaldehyde, m-nitro,5-nitrobenzaldehyde,unii-g4o92ko71z,3-nitro-benzaldehyde,ccris 1784,m-nitro-benzaldehyde PubChem CID: 7449 IUPAC Name: 3-nitrobenzaldehyde SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])C=O

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Specifications

PubChem CID	7449
CAS	99-61-6
Molecular Weight (g/mol)	151.12
MDL Number	MFCD00007249
SMILES	C1=CC(=CC(=C1)[N+](=O)[O-])C=O
Synonym	m-nitrobenzaldehyde,benzaldehyde, 3-nitro,3-formylnitrobenzene,meta-nitrobenzaldehyde,benzaldehyde, m-nitro,5-nitrobenzaldehyde,unii-g4o92ko71z,3-nitro-benzaldehyde,ccris 1784,m-nitro-benzaldehyde
IUPAC Name	3-nitrobenzaldehyde
InChI Key	ZETIVVHRRQLWFW-UHFFFAOYSA-N
Molecular Formula	C₇H₅NO₃

4-Nitroanisole, 99+%

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Specifications

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

5-Methoxy-2-nitroaniline, 98%

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

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

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Specifications

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-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

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Specifications

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

2,6-Dimethyl-4-nitroanisole, 99%

CAS: 14804-39-8 Molecular Formula: C9H11NO3 Molecular Weight (g/mol): 181.19 MDL Number: MFCD00024537 InChI Key: HSDNHFOJTRMGER-UHFFFAOYSA-N Synonym: 2,6-dimethyl-4-nitroanisole,m-xylene, 2-methoxy-5-nitro,benzene,2-methoxy-1,3-dimethyl-5-nitro,acmc-20ao84,m-xylene, 2-methoxy-5-nitro-,,4-methoxy-3,5-dimethylnitrobenzene,2,6-dimethyl-1-methoxy-4-nitrobenzene,2-methoxy-1,3-di-methyl-5-nitrobenzene,benzene, 2-methoxy-1,3-dimethyl-5-nitro PubChem CID: 139835 IUPAC Name: 2-methoxy-1,3-dimethyl-5-nitrobenzene SMILES: COC1=C(C)C=C(C=C1C)[N+]([O-])=O

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Specifications

PubChem CID	139835
CAS	14804-39-8
Molecular Weight (g/mol)	181.19
MDL Number	MFCD00024537
SMILES	COC1=C(C)C=C(C=C1C)[N+]([O-])=O
Synonym	2,6-dimethyl-4-nitroanisole,m-xylene, 2-methoxy-5-nitro,benzene,2-methoxy-1,3-dimethyl-5-nitro,acmc-20ao84,m-xylene, 2-methoxy-5-nitro-,,4-methoxy-3,5-dimethylnitrobenzene,2,6-dimethyl-1-methoxy-4-nitrobenzene,2-methoxy-1,3-di-methyl-5-nitrobenzene,benzene, 2-methoxy-1,3-dimethyl-5-nitro
IUPAC Name	2-methoxy-1,3-dimethyl-5-nitrobenzene
InChI Key	HSDNHFOJTRMGER-UHFFFAOYSA-N
Molecular Formula	C9H11NO3

1-(4-bromobutoxy)-4-nitrobenzene, 85%, Thermo Scientific™

CAS: 55502-03-9 Molecular Formula: C₁₀H₁₂BrNO₃ Molecular Weight (g/mol): 274.11 MDL Number: MFCD00980317 InChI Key: DBRBCFJUEVSKGZ-UHFFFAOYSA-N Synonym: 1-4-bromobutoxy-4-nitrobenzene,4-nitrophenoxybutyl bromide PubChem CID: 2063669 IUPAC Name: 1-(4-bromobutoxy)-4-nitrobenzene SMILES: C1=CC(=CC=C1[N+](=O)[O-])OCCCCBr

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Specifications

PubChem CID	2063669
CAS	55502-03-9
Molecular Weight (g/mol)	274.11
MDL Number	MFCD00980317
SMILES	C1=CC(=CC=C1[N+](=O)[O-])OCCCCBr
Synonym	1-4-bromobutoxy-4-nitrobenzene,4-nitrophenoxybutyl bromide
IUPAC Name	1-(4-bromobutoxy)-4-nitrobenzene
InChI Key	DBRBCFJUEVSKGZ-UHFFFAOYSA-N
Molecular Formula	C₁₀H₁₂BrNO₃

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