Nitrotoluenes

Organic compounds that consist of a toluene molecule with a nitro group substitution; a nitro group has a nitrogen atom bonded to two oxygen groups in a single and a double bond. A toluene molecule is a benzene with a methyl group substitution.

1 – 15 of 89 results

4-Nitrotoluene, 99%, Thermo Scientific Chemicals

CAS: 99-99-0 Molecular Formula: C7H7NO2 Molecular Weight (g/mol): 137.14 MDL Number: MFCD00007366 InChI Key: ZPTVNYMJQHSSEA-UHFFFAOYSA-N Synonym: 4-nitrotoluene,p-nitrotoluene,4-methylnitrobenzene,4-nitrotoluol,benzene, 1-methyl-4-nitro,toluene, p-nitro,p-methylnitrobenzene,para-nitrotoluol,nitrotoluenos,nitrotoluene, p PubChem CID: 7473 ChEBI: CHEBI:35227 IUPAC Name: 1-methyl-4-nitrobenzene SMILES: CC1=CC=C(C=C1)[N+]([O-])=O

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PubChem CID	7473
CAS	99-99-0
Molecular Weight (g/mol)	137.14
ChEBI	CHEBI:35227
MDL Number	MFCD00007366
SMILES	CC1=CC=C(C=C1)[N+]([O-])=O
Synonym	4-nitrotoluene,p-nitrotoluene,4-methylnitrobenzene,4-nitrotoluol,benzene, 1-methyl-4-nitro,toluene, p-nitro,p-methylnitrobenzene,para-nitrotoluol,nitrotoluenos,nitrotoluene, p
IUPAC Name	1-methyl-4-nitrobenzene
InChI Key	ZPTVNYMJQHSSEA-UHFFFAOYSA-N
Molecular Formula	C7H7NO2

2-Nitrotoluene, 99+%, Thermo Scientific Chemicals

CAS: 88-72-2 Molecular Formula: C₇H₇NO₂ Molecular Weight (g/mol): 137.14 InChI Key: PLAZTCDQAHEYBI-UHFFFAOYSA-N Synonym: 2-nitrotoluene,o-nitrotoluene,o-nitrotoluol,o-methylnitrobenzene,benzene, 1-methyl-2-nitro,toluene, o-nitro,2-methyl-1-nitrobenzene,2-nitrotoluol,ortho-nitrotoluol,2-methylnitrobenzene PubChem CID: 6944 ChEBI: CHEBI:33098 IUPAC Name: 1-methyl-2-nitrobenzene SMILES: CC1=CC=CC=C1[N+](=O)[O-]

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PubChem CID	6944
CAS	88-72-2
Molecular Weight (g/mol)	137.14
ChEBI	CHEBI:33098
SMILES	CC1=CC=CC=C1[N+](=O)[O-]
Synonym	2-nitrotoluene,o-nitrotoluene,o-nitrotoluol,o-methylnitrobenzene,benzene, 1-methyl-2-nitro,toluene, o-nitro,2-methyl-1-nitrobenzene,2-nitrotoluol,ortho-nitrotoluol,2-methylnitrobenzene
IUPAC Name	1-methyl-2-nitrobenzene
InChI Key	PLAZTCDQAHEYBI-UHFFFAOYSA-N
Molecular Formula	C₇H₇NO₂

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

CAS: 89-62-3 Molecular Formula: C7H8N2O2 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00007907 InChI Key: DLURHXYXQYMPLT-UHFFFAOYSA-N Synonym: 2-nitro-p-toluidine,4-amino-3-nitrotoluene,3-nitro-4-toluidine,fast red gl,3-nitro-4-aminotoluene,fast red gl base,benzenamine, 4-methyl-2-nitro,2-nitro-4-methylaniline,4-methyl-6-nitroaniline,mnpt PubChem CID: 6978 ChEBI: CHEBI:66920 IUPAC Name: 4-methyl-2-nitroaniline SMILES: CC1=CC=C(N)C(=C1)[N+]([O-])=O

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PubChem CID	6978
CAS	89-62-3
Molecular Weight (g/mol)	152.15
ChEBI	CHEBI:66920
MDL Number	MFCD00007907
SMILES	CC1=CC=C(N)C(=C1)[N+]([O-])=O
Synonym	2-nitro-p-toluidine,4-amino-3-nitrotoluene,3-nitro-4-toluidine,fast red gl,3-nitro-4-aminotoluene,fast red gl base,benzenamine, 4-methyl-2-nitro,2-nitro-4-methylaniline,4-methyl-6-nitroaniline,mnpt
IUPAC Name	4-methyl-2-nitroaniline
InChI Key	DLURHXYXQYMPLT-UHFFFAOYSA-N
Molecular Formula	C7H8N2O2

5-Fluoro-2-nitrotoluene, 98+%, Thermo Scientific Chemicals

CAS: 446-33-3 Molecular Formula: C7H6FNO2 Molecular Weight (g/mol): 155.128 MDL Number: MFCD00007283 InChI Key: JHFOWEGCZWLHNW-UHFFFAOYSA-N Synonym: 5-fluoro-2-nitrotoluene,3-fluoro-6-nitrotoluene,4-fluoro-2-methylnitrobenzene,2-nitro-5-fluoro toluene,benzene, 4-fluoro-2-methyl-1-nitro,toluene, 5-fluoro-2-nitro,2-nitro-5-fluorotoluene,2-methyl-4-fluoronitrobenzene,3-methyl-4-nitrofluorobenzene,4-fluoro-2-methyl-1-nitro-benzene PubChem CID: 94956 IUPAC Name: 4-fluoro-2-methyl-1-nitrobenzene SMILES: CC1=C(C=CC(=C1)F)[N+](=O)[O-]

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PubChem CID	94956
CAS	446-33-3
Molecular Weight (g/mol)	155.128
MDL Number	MFCD00007283
SMILES	CC1=C(C=CC(=C1)F)[N+](=O)[O-]
Synonym	5-fluoro-2-nitrotoluene,3-fluoro-6-nitrotoluene,4-fluoro-2-methylnitrobenzene,2-nitro-5-fluoro toluene,benzene, 4-fluoro-2-methyl-1-nitro,toluene, 5-fluoro-2-nitro,2-nitro-5-fluorotoluene,2-methyl-4-fluoronitrobenzene,3-methyl-4-nitrofluorobenzene,4-fluoro-2-methyl-1-nitro-benzene
IUPAC Name	4-fluoro-2-methyl-1-nitrobenzene
InChI Key	JHFOWEGCZWLHNW-UHFFFAOYSA-N
Molecular Formula	C7H6FNO2

3-Methyl-4-nitrobenzonitrile, 97%, Thermo Scientific Chemicals

CAS: 96784-54-2 Molecular Formula: C8H6N2O2 Molecular Weight (g/mol): 162.148 MDL Number: MFCD00017615 InChI Key: IHVNKSXTJZNBQA-UHFFFAOYSA-N Synonym: benzonitrile, 3-methyl-4-nitro,5-cyano-2-nitrotoluene,3-methyl-4-nitro-benzonitrile,3-methyl-4-nitrobenzenecarbonitrile,4-nitro-m-tolunitrile,4-cyano-2-methylnitrobenzene,ihvnksxtjznbqa-uhfffaoysa PubChem CID: 2801434 IUPAC Name: 3-methyl-4-nitrobenzonitrile SMILES: CC1=C(C=CC(=C1)C#N)[N+](=O)[O-]

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PubChem CID	2801434
CAS	96784-54-2
Molecular Weight (g/mol)	162.148
MDL Number	MFCD00017615
SMILES	CC1=C(C=CC(=C1)C#N)[N+](=O)[O-]
Synonym	benzonitrile, 3-methyl-4-nitro,5-cyano-2-nitrotoluene,3-methyl-4-nitro-benzonitrile,3-methyl-4-nitrobenzenecarbonitrile,4-nitro-m-tolunitrile,4-cyano-2-methylnitrobenzene,ihvnksxtjznbqa-uhfffaoysa
IUPAC Name	3-methyl-4-nitrobenzonitrile
InChI Key	IHVNKSXTJZNBQA-UHFFFAOYSA-N
Molecular Formula	C8H6N2O2

2-Methyl-5-nitroaniline, 98+%, Thermo Scientific Chemicals

CAS: 99-55-8 Molecular Formula: C7H8N2O2 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00007741 InChI Key: DSBIJCMXAIKKKI-UHFFFAOYSA-N Synonym: 2-amino-4-nitrotoluene,5-nitro-o-toluidine,fast scarlet g,pnot,scarlet g base,2-methyl-5-nitrobenzenamine,4-nitro-2-aminotoluene,devol scarlet b,diabase scarlet g,scarlet base nsp PubChem CID: 7444 ChEBI: CHEBI:66891 IUPAC Name: 2-methyl-5-nitroaniline SMILES: CC1=CC=C(C=C1N)[N+]([O-])=O

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PubChem CID	7444
CAS	99-55-8
Molecular Weight (g/mol)	152.15
ChEBI	CHEBI:66891
MDL Number	MFCD00007741
SMILES	CC1=CC=C(C=C1N)[N+]([O-])=O
Synonym	2-amino-4-nitrotoluene,5-nitro-o-toluidine,fast scarlet g,pnot,scarlet g base,2-methyl-5-nitrobenzenamine,4-nitro-2-aminotoluene,devol scarlet b,diabase scarlet g,scarlet base nsp
IUPAC Name	2-methyl-5-nitroaniline
InChI Key	DSBIJCMXAIKKKI-UHFFFAOYSA-N
Molecular Formula	C7H8N2O2

1-Fluoro-3,5-dimethyl-2-nitrobenzene, 97%, Thermo Scientific Chemicals

CAS: 315-13-9 Molecular Formula: C8H8FNO2 Molecular Weight (g/mol): 169.155 MDL Number: MFCD00052367 InChI Key: XGLWCYVNZDSDNQ-UHFFFAOYSA-N Synonym: benzene, 1-fluoro-3,5-dimethyl-2-nitro,5-fluoro-4-nitro-m-xylene,4,6-dimethyl-2-fluoronitrobenzene,2-fluoro-4,6-dimethyl-nitrobenzene,1,3-dimethyl-5-fluoro-4-nitrobenzene,benzene,1-fluoro-3,5-dimethyl-2-nitro PubChem CID: 21875915 IUPAC Name: 1-fluoro-3,5-dimethyl-2-nitrobenzene SMILES: CC1=CC(=C(C(=C1)F)[N+](=O)[O-])C

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PubChem CID	21875915
CAS	315-13-9
Molecular Weight (g/mol)	169.155
MDL Number	MFCD00052367
SMILES	CC1=CC(=C(C(=C1)F)[N+](=O)[O-])C
Synonym	benzene, 1-fluoro-3,5-dimethyl-2-nitro,5-fluoro-4-nitro-m-xylene,4,6-dimethyl-2-fluoronitrobenzene,2-fluoro-4,6-dimethyl-nitrobenzene,1,3-dimethyl-5-fluoro-4-nitrobenzene,benzene,1-fluoro-3,5-dimethyl-2-nitro
IUPAC Name	1-fluoro-3,5-dimethyl-2-nitrobenzene
InChI Key	XGLWCYVNZDSDNQ-UHFFFAOYSA-N
Molecular Formula	C8H8FNO2

4-Methyl-3-nitrobenzeneboronic acid, 98%, Thermo Scientific Chemicals

CAS: 80500-27-2 Molecular Formula: C7H8BNO4 Molecular Weight (g/mol): 180.954 MDL Number: MFCD00191550 InChI Key: OASVXBRTNVFKFS-UHFFFAOYSA-N Synonym: 4-methyl-3-nitrophenyl boronic acid,4-methyl-3-nitrobenzeneboronic acid,3-nitro-p-tolylboronic acid,4-methyl-3-nitrophenyl boranediol,4-methyl-3-nitro-phenyl boronic acid,3-nitro-4-methylphenylboronic acid,2-nitrotoluene-4-boronic acid,boronic acid, 4-methyl-3-nitrophenyl,3-nitro-4-methylbenzeneboronic acid PubChem CID: 2773515 IUPAC Name: (4-methyl-3-nitrophenyl)boronic acid SMILES: B(C1=CC(=C(C=C1)C)[N+](=O)[O-])(O)O

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PubChem CID	2773515
CAS	80500-27-2
Molecular Weight (g/mol)	180.954
MDL Number	MFCD00191550
SMILES	B(C1=CC(=C(C=C1)C)[N+](=O)[O-])(O)O
Synonym	4-methyl-3-nitrophenyl boronic acid,4-methyl-3-nitrobenzeneboronic acid,3-nitro-p-tolylboronic acid,4-methyl-3-nitrophenyl boranediol,4-methyl-3-nitro-phenyl boronic acid,3-nitro-4-methylphenylboronic acid,2-nitrotoluene-4-boronic acid,boronic acid, 4-methyl-3-nitrophenyl,3-nitro-4-methylbenzeneboronic acid
IUPAC Name	(4-methyl-3-nitrophenyl)boronic acid
InChI Key	OASVXBRTNVFKFS-UHFFFAOYSA-N
Molecular Formula	C7H8BNO4

2-Nitrotoluene, 99+%, Thermo Scientific Chemicals

CAS: 88-72-2 Molecular Formula: C7H7NO2 Molecular Weight (g/mol): 137.138 MDL Number: MFCD00007157 InChI Key: PLAZTCDQAHEYBI-UHFFFAOYSA-N Synonym: 2-nitrotoluene,o-nitrotoluene,o-nitrotoluol,o-methylnitrobenzene,benzene, 1-methyl-2-nitro,toluene, o-nitro,2-methyl-1-nitrobenzene,2-nitrotoluol,ortho-nitrotoluol,2-methylnitrobenzene PubChem CID: 6944 ChEBI: CHEBI:33098 IUPAC Name: 1-methyl-2-nitrobenzene SMILES: CC1=CC=CC=C1[N+](=O)[O-]

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PubChem CID	6944
CAS	88-72-2
Molecular Weight (g/mol)	137.138
ChEBI	CHEBI:33098
MDL Number	MFCD00007157
SMILES	CC1=CC=CC=C1[N+](=O)[O-]
Synonym	2-nitrotoluene,o-nitrotoluene,o-nitrotoluol,o-methylnitrobenzene,benzene, 1-methyl-2-nitro,toluene, o-nitro,2-methyl-1-nitrobenzene,2-nitrotoluol,ortho-nitrotoluol,2-methylnitrobenzene
IUPAC Name	1-methyl-2-nitrobenzene
InChI Key	PLAZTCDQAHEYBI-UHFFFAOYSA-N
Molecular Formula	C7H7NO2

2-Iodo-4-nitrotoluene, 97%, Thermo Scientific Chemicals

CAS: 7745-92-8 Molecular Formula: C7H6INO2 Molecular Weight (g/mol): 263.03 MDL Number: MFCD00024329 InChI Key: BUQSRXQJUZTIEW-UHFFFAOYSA-N Synonym: 2-iodo-4-nitrotoluene,benzene, 2-iodo-1-methyl-4-nitro,2-iodo-1-methyl-4-nitro-benzene,pubchem3957,acmc-209pa2,toluene, 2-iodo-4-nitro,timtec-bb sbb005821 PubChem CID: 82188 IUPAC Name: 2-iodo-1-methyl-4-nitrobenzene SMILES: CC1=CC=C(C=C1I)[N+]([O-])=O

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PubChem CID	82188
CAS	7745-92-8
Molecular Weight (g/mol)	263.03
MDL Number	MFCD00024329
SMILES	CC1=CC=C(C=C1I)[N+]([O-])=O
Synonym	2-iodo-4-nitrotoluene,benzene, 2-iodo-1-methyl-4-nitro,2-iodo-1-methyl-4-nitro-benzene,pubchem3957,acmc-209pa2,toluene, 2-iodo-4-nitro,timtec-bb sbb005821
IUPAC Name	2-iodo-1-methyl-4-nitrobenzene
InChI Key	BUQSRXQJUZTIEW-UHFFFAOYSA-N
Molecular Formula	C7H6INO2

Dinitrodurene, 97%, Thermo Scientific™

CAS: 5465-13-4 InChI Key: AEPQXGFMAZTUEA-UHFFFAOYSA-N Synonym: 1,2,4,5-tetramethyl-3,6-dinitro-benzene,dinitrotrodurene,3,2,4,5-tetramethylbenzene,2,3,5,6-tetramethyl-p-dinitrobenzene,1,4,5-tetramethyl-3,6-dinitrobenzene,benzene,2,4,5-tetramethyl-3,6-dinitro,1,4-dinitro-2,3,5,6-tetramethylbenzene 97+% PubChem CID: 79593 IUPAC Name: 1,2,4,5-tetramethyl-3,6-dinitrobenzene SMILES: CC1=C(C(=C(C(=C1[N+](=O)[O-])C)C)[N+](=O)[O-])C

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PubChem CID	79593
CAS	5465-13-4
SMILES	CC1=C(C(=C(C(=C1[N+](=O)[O-])C)C)[N+](=O)[O-])C
Synonym	1,2,4,5-tetramethyl-3,6-dinitro-benzene,dinitrotrodurene,3,2,4,5-tetramethylbenzene,2,3,5,6-tetramethyl-p-dinitrobenzene,1,4,5-tetramethyl-3,6-dinitrobenzene,benzene,2,4,5-tetramethyl-3,6-dinitro,1,4-dinitro-2,3,5,6-tetramethylbenzene 97+%
IUPAC Name	1,2,4,5-tetramethyl-3,6-dinitrobenzene
InChI Key	AEPQXGFMAZTUEA-UHFFFAOYSA-N

4-Methyl-3-nitrobenzonitrile, 98%, Thermo Scientific™

CAS: 939-79-7 Molecular Formula: C8H6N2O2 Molecular Weight (g/mol): 162.148 MDL Number: MFCD00031482 InChI Key: KOFBNBCOGKLUOM-UHFFFAOYSA-N Synonym: 3-nitro-4-methylbenzonitrile,3-nitro-p-tolunitrile,4-methyl-3-nitro-benzonitrile,benzonitrile, 4-methyl-3-nitro,4-cyano-2-nitrotoluene,4-methyl-3-nitrobenzenecarbonitrile,5-cyano-2-methylnitrobenzene,2-nitro-p-toluonitrile,pubchem4817,acmc-209gtb PubChem CID: 589333 IUPAC Name: 4-methyl-3-nitrobenzonitrile SMILES: CC1=C(C=C(C=C1)C#N)[N+](=O)[O-]

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PubChem CID	589333
CAS	939-79-7
Molecular Weight (g/mol)	162.148
MDL Number	MFCD00031482
SMILES	CC1=C(C=C(C=C1)C#N)[N+](=O)[O-]
Synonym	3-nitro-4-methylbenzonitrile,3-nitro-p-tolunitrile,4-methyl-3-nitro-benzonitrile,benzonitrile, 4-methyl-3-nitro,4-cyano-2-nitrotoluene,4-methyl-3-nitrobenzenecarbonitrile,5-cyano-2-methylnitrobenzene,2-nitro-p-toluonitrile,pubchem4817,acmc-209gtb
IUPAC Name	4-methyl-3-nitrobenzonitrile
InChI Key	KOFBNBCOGKLUOM-UHFFFAOYSA-N
Molecular Formula	C8H6N2O2

4,6-Dimethyl-2-nitroaniline, 97%, Thermo Scientific Chemicals

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4-Chloro-2-methyl-6-nitroaniline, 97%, Thermo Scientific™

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4-Chloro-3-nitrotoluene, 97+%, Thermo Scientific Chemicals

CAS: 89-60-1 Molecular Formula: C7H6ClNO2 Molecular Weight (g/mol): 171.58 MDL Number: MFCD00007085 InChI Key: NWESJZZPAJGHRZ-UHFFFAOYSA-N Synonym: 4-chloro-3-nitrotoluene,3-nitro-4-chlorotoluene,benzene, 1-chloro-4-methyl-2-nitro,2-chloro-5-methylnitrobenzene,1-chloro-4-methyl-2-nitro-benzene,toluene, 4-chloro-3-nitro,3-nitro-4-chlorotoluol,pubchem19752,4,3-chloronitrotoluene,4-chloro-3-nitro-toluene PubChem CID: 6976 IUPAC Name: 1-chloro-4-methyl-2-nitrobenzene SMILES: CC1=CC=C(Cl)C(=C1)[N+]([O-])=O

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PubChem CID	6976
CAS	89-60-1
Molecular Weight (g/mol)	171.58
MDL Number	MFCD00007085
SMILES	CC1=CC=C(Cl)C(=C1)[N+]([O-])=O
Synonym	4-chloro-3-nitrotoluene,3-nitro-4-chlorotoluene,benzene, 1-chloro-4-methyl-2-nitro,2-chloro-5-methylnitrobenzene,1-chloro-4-methyl-2-nitro-benzene,toluene, 4-chloro-3-nitro,3-nitro-4-chlorotoluol,pubchem19752,4,3-chloronitrotoluene,4-chloro-3-nitro-toluene
IUPAC Name	1-chloro-4-methyl-2-nitrobenzene
InChI Key	NWESJZZPAJGHRZ-UHFFFAOYSA-N
Molecular Formula	C7H6ClNO2

Nitrotoluenes

Nitrotoluenes

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