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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.

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1 – 10 of 10 results
1

2-Methyl-3-nitrophenylacetic acid, 96%

CAS: 23876-15-5 Molecular Formula: C9H9NO4 Molecular Weight (g/mol): 195.174 MDL Number: MFCD07782132 InChI Key: LWIOFILTAJJDLA-UHFFFAOYSA-N Synonym: 2-methyl-3-nitrophenylacetic acid,2-methyl-3-nitrophenyl acetic acid,2-2-methyl-3-nitrophenyl acetic acid,2-methyl-3-nitro-benzeneacetic acid,3-nitro-o-tolyl acetic acid,benzeneacetic acid, 2-methyl-3-nitro,2-methyl-3-nitrophenylaceticacid,2-methyl-3-nitrobenzeneacetic acid,2-methyl-3-nitro phenyl acetic acid,pubchem18230 PubChem CID: 13530897 SMILES: CC1=C(C=CC=C1[N+](=O)[O-])CC(=O)O

PubChem CID 13530897
CAS 23876-15-5
Molecular Weight (g/mol) 195.174
MDL Number MFCD07782132
SMILES CC1=C(C=CC=C1[N+](=O)[O-])CC(=O)O
Synonym 2-methyl-3-nitrophenylacetic acid,2-methyl-3-nitrophenyl acetic acid,2-2-methyl-3-nitrophenyl acetic acid,2-methyl-3-nitro-benzeneacetic acid,3-nitro-o-tolyl acetic acid,benzeneacetic acid, 2-methyl-3-nitro,2-methyl-3-nitrophenylaceticacid,2-methyl-3-nitrobenzeneacetic acid,2-methyl-3-nitro phenyl acetic acid,pubchem18230
InChI Key LWIOFILTAJJDLA-UHFFFAOYSA-N
Molecular Formula C9H9NO4
2

4-Methyl-3-nitrobenzeneboronic acid, 98%

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

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
3

4-[(1-Ethylpropyl)amino]-2-methyl-3,5-dinitro-benzoic Acid, TRC

CAS: 127971-53-3 Molecular Formula: C13H17N3O6 Molecular Weight (g/mol): 311.29 SMILES: CC1=C(C(O)=O)C=C([N+]([O-])=O)C(NC(CC)CC)=C1[N+]([O-])=O

CAS 127971-53-3
Molecular Weight (g/mol) 311.29
SMILES CC1=C(C(O)=O)C=C([N+]([O-])=O)C(NC(CC)CC)=C1[N+]([O-])=O
Molecular Formula C13H17N3O6
4

4-Methyl-3-nitrobenzenesulfonyl chloride, 95%, Thermo Scientific Chemicals

CAS: 616-83-1 Molecular Formula: C7H6ClNO4S Molecular Weight (g/mol): 235.638 MDL Number: MFCD00129811 InChI Key: OQFYBGANSUNUAO-UHFFFAOYSA-N Synonym: 4-methyl-3-nitrobenzene-1-sulfonyl chloride,2-nitrotoluene-4-sulfonyl chloride,4-methyl-3-nitro-benzenesulfonyl chloride,4-methyl-3-nitrobenzenesulfonylchloride,chloro 4-methyl-3-nitrophenyl sulfone,4-methyl-3-nitrobenzolsulfonylchlorid,pubchem5674,acmc-1awd3,3-nitro-p-toluenesulfonyl chloride,3-nitro-4-methyl phenylsulfonyl chloride PubChem CID: 560638 IUPAC Name: 4-methyl-3-nitrobenzenesulfonyl chloride SMILES: CC1=C(C=C(C=C1)S(=O)(=O)Cl)[N+](=O)[O-]

PubChem CID 560638
CAS 616-83-1
Molecular Weight (g/mol) 235.638
MDL Number MFCD00129811
SMILES CC1=C(C=C(C=C1)S(=O)(=O)Cl)[N+](=O)[O-]
Synonym 4-methyl-3-nitrobenzene-1-sulfonyl chloride,2-nitrotoluene-4-sulfonyl chloride,4-methyl-3-nitro-benzenesulfonyl chloride,4-methyl-3-nitrobenzenesulfonylchloride,chloro 4-methyl-3-nitrophenyl sulfone,4-methyl-3-nitrobenzolsulfonylchlorid,pubchem5674,acmc-1awd3,3-nitro-p-toluenesulfonyl chloride,3-nitro-4-methyl phenylsulfonyl chloride
IUPAC Name 4-methyl-3-nitrobenzenesulfonyl chloride
InChI Key OQFYBGANSUNUAO-UHFFFAOYSA-N
Molecular Formula C7H6ClNO4S
5

2-Methyl-5-nitrobenzenesulfonyl chloride, 97%

CAS: 121-02-8 Molecular Formula: C7H6ClNO4S Molecular Weight (g/mol): 235.64 MDL Number: MFCD00051695 InChI Key: WPGVQDHXOUAJBW-UHFFFAOYSA-N Synonym: 2-methyl-5-nitrobenzene-1-sulfonyl chloride,5-nitro-o-toluenesulfonyl chloride,2-methyl-5-nitrobenzenesulfonylchloride,benzenesulfonyl chloride, 2-methyl-5-nitro,4-nitrotoluen-2-sulfochlorid,o-toluenesulfonyl chloride, 5-nitro,4-nitrotoluen-2-sulfonylchlorid,4-nitrotoluene-2-sulphonyl chloride,4-nitrotoluen-2-sulfochlorid czech,2-methyl-5-nitrophenylsulfonyl chloride PubChem CID: 8457 IUPAC Name: 2-methyl-5-nitrobenzenesulfonyl chloride SMILES: CC1=CC=C(C=C1S(Cl)(=O)=O)[N+]([O-])=O

PubChem CID 8457
CAS 121-02-8
Molecular Weight (g/mol) 235.64
MDL Number MFCD00051695
SMILES CC1=CC=C(C=C1S(Cl)(=O)=O)[N+]([O-])=O
Synonym 2-methyl-5-nitrobenzene-1-sulfonyl chloride,5-nitro-o-toluenesulfonyl chloride,2-methyl-5-nitrobenzenesulfonylchloride,benzenesulfonyl chloride, 2-methyl-5-nitro,4-nitrotoluen-2-sulfochlorid,o-toluenesulfonyl chloride, 5-nitro,4-nitrotoluen-2-sulfonylchlorid,4-nitrotoluene-2-sulphonyl chloride,4-nitrotoluen-2-sulfochlorid czech,2-methyl-5-nitrophenylsulfonyl chloride
IUPAC Name 2-methyl-5-nitrobenzenesulfonyl chloride
InChI Key WPGVQDHXOUAJBW-UHFFFAOYSA-N
Molecular Formula C7H6ClNO4S
6
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2-Methyl-4-nitroaniline, 99%

CAS: 99-52-5 Molecular Formula: C7H8N2O2 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00007734 InChI Key: XTTIQGSLJBWVIV-UHFFFAOYSA-N Synonym: 2-amino-5-nitrotoluene,4-nitro-o-toluidine,5-nitro-2-aminotoluene,p-nitro-o-toluidine,benzenamine, 2-methyl-4-nitro,fast red rl base,1-amino-2-methyl-4-nitrobenzene,diabase red rl,ansibases red rl,devol red rl PubChem CID: 7441 IUPAC Name: 2-methyl-4-nitroaniline SMILES: CC1=CC(=CC=C1N)[N+]([O-])=O

PubChem CID 7441
CAS 99-52-5
Molecular Weight (g/mol) 152.15
MDL Number MFCD00007734
SMILES CC1=CC(=CC=C1N)[N+]([O-])=O
Synonym 2-amino-5-nitrotoluene,4-nitro-o-toluidine,5-nitro-2-aminotoluene,p-nitro-o-toluidine,benzenamine, 2-methyl-4-nitro,fast red rl base,1-amino-2-methyl-4-nitrobenzene,diabase red rl,ansibases red rl,devol red rl
IUPAC Name 2-methyl-4-nitroaniline
InChI Key XTTIQGSLJBWVIV-UHFFFAOYSA-N
Molecular Formula C7H8N2O2
7

Alfa Aesar™ 2-Methyl-5-nitrobenzeneboronic acid, 96%

CAS: 100960-11-0 Molecular Formula: C7H8BNO4 Molecular Weight (g/mol): 180.954 MDL Number: MFCD00757435 InChI Key: HRJFQIRIDFXMNX-UHFFFAOYSA-N Synonym: 2-methyl-5-nitrophenyl boronic acid,2-methyl-5-nitrobenzeneboronic acid,2-methyl-5-nitrophenyl boranediol,boronic acid,b-2-methyl-5-nitrophenyl,5-nitro-2-methyl-phenylboronic acid,2-dimethyl-3-nitrophenylboronic acid,2-borono-4-nitrotoluene,acmc-2097th,3-borono-4-methylnitrobenzene,2-methyl-5-nitrophenyl-boronic acid PubChem CID: 2773513 IUPAC Name: (2-methyl-5-nitrophenyl)boronic acid SMILES: B(C1=C(C=CC(=C1)[N+](=O)[O-])C)(O)O

PubChem CID 2773513
CAS 100960-11-0
Molecular Weight (g/mol) 180.954
MDL Number MFCD00757435
SMILES B(C1=C(C=CC(=C1)[N+](=O)[O-])C)(O)O
Synonym 2-methyl-5-nitrophenyl boronic acid,2-methyl-5-nitrobenzeneboronic acid,2-methyl-5-nitrophenyl boranediol,boronic acid,b-2-methyl-5-nitrophenyl,5-nitro-2-methyl-phenylboronic acid,2-dimethyl-3-nitrophenylboronic acid,2-borono-4-nitrotoluene,acmc-2097th,3-borono-4-methylnitrobenzene,2-methyl-5-nitrophenyl-boronic acid
IUPAC Name (2-methyl-5-nitrophenyl)boronic acid
InChI Key HRJFQIRIDFXMNX-UHFFFAOYSA-N
Molecular Formula C7H8BNO4
8

2-Methyl-5-nitrophenylboronic acid pinacol ester, 97%, Thermo Scientific™

CAS: 957062-84-9 Molecular Formula: C13H18BNO4 Molecular Weight (g/mol): 263.1 InChI Key: LYFUUPOOXAXEEP-UHFFFAOYSA-N Synonym: 4,4,5,5-tetramethyl-2-2-methyl-5-nitrophenyl-1,3,2-dioxaborolane,2-methyl-5-nitrophenylboronic acid pinacol ester,2-methyl-5-nitrophenylboronic acid, pinacol ester,2-methyl-5-nitrophenyl boric acid pinacol ester,3-hydroxy-2,3-dimethylbutan-2-yl hydrogen 2-methyl-5-nitrophenylboronate,pubchem18757,2-methyl-5-nitrophenylboronicacidpinacolester,2-methyl-5-nitrobenzeneboronic acid, pinacol ester,4,4,5,5-tetramethyl-2-2-methyl-5-nitro-phenyl-1,3,2-dioxaborolane,1,3,2-dioxaborolane, 4,4,5,5-tetramethyl-2-2-methyl-5-nitrophenyl PubChem CID: 17750269 IUPAC Name: 4,4,5,5-tetramethyl-2-(2-methyl-5-nitrophenyl)-1,3,2-dioxaborolane SMILES: B1(OC(C(O1)(C)C)(C)C)C2=C(C=CC(=C2)[N+](=O)[O-])C

PubChem CID 17750269
CAS 957062-84-9
Molecular Weight (g/mol) 263.1
SMILES B1(OC(C(O1)(C)C)(C)C)C2=C(C=CC(=C2)[N+](=O)[O-])C
Synonym 4,4,5,5-tetramethyl-2-2-methyl-5-nitrophenyl-1,3,2-dioxaborolane,2-methyl-5-nitrophenylboronic acid pinacol ester,2-methyl-5-nitrophenylboronic acid, pinacol ester,2-methyl-5-nitrophenyl boric acid pinacol ester,3-hydroxy-2,3-dimethylbutan-2-yl hydrogen 2-methyl-5-nitrophenylboronate,pubchem18757,2-methyl-5-nitrophenylboronicacidpinacolester,2-methyl-5-nitrobenzeneboronic acid, pinacol ester,4,4,5,5-tetramethyl-2-2-methyl-5-nitro-phenyl-1,3,2-dioxaborolane,1,3,2-dioxaborolane, 4,4,5,5-tetramethyl-2-2-methyl-5-nitrophenyl
IUPAC Name 4,4,5,5-tetramethyl-2-(2-methyl-5-nitrophenyl)-1,3,2-dioxaborolane
InChI Key LYFUUPOOXAXEEP-UHFFFAOYSA-N
Molecular Formula C13H18BNO4
9

2-Fluoro-4-methyl-5-nitrobenzeneboronic acid pinacol ester, 96%, Thermo Scientific™

CAS: 1510828-68-8 Molecular Formula: C13H17BFNO4 Molecular Weight (g/mol): 281.09 InChI Key: VJFYRTJYOVWHNP-UHFFFAOYSA-N Synonym: 2-2-fluoro-4-methyl-5-nitrophenyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,2-fluoro-4-methyl-5-nitrophenyl boronic acid pinacol ester PubChem CID: 74789592 IUPAC Name: 2-(2-fluoro-4-methyl-5-nitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(=C(C=C2F)C)[N+](=O)[O-]

PubChem CID 74789592
CAS 1510828-68-8
Molecular Weight (g/mol) 281.09
SMILES B1(OC(C(O1)(C)C)(C)C)C2=CC(=C(C=C2F)C)[N+](=O)[O-]
Synonym 2-2-fluoro-4-methyl-5-nitrophenyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,2-fluoro-4-methyl-5-nitrophenyl boronic acid pinacol ester
IUPAC Name 2-(2-fluoro-4-methyl-5-nitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI Key VJFYRTJYOVWHNP-UHFFFAOYSA-N
Molecular Formula C13H17BFNO4
10

5-(2-Methyl-4-nitrophenyl)furan-2-carbonyl chloride, Thermo Scientific™

CAS: 381178-60-5 Molecular Formula: C12H8ClNO4 Molecular Weight (g/mol): 265.65 MDL Number: MFCD02257980 InChI Key: VBNSSVYGFDMJIZ-UHFFFAOYSA-N Synonym: 5-2-methyl-4-nitrophenyl furan-2-carbonyl chloride,acmc-1ctfv,2-furancarbonylchloride, 5-2-methyl-4-nitrophenyl,5-2-methyl-4-nitro-phenyl-furan-2-carbonyl chloride PubChem CID: 4484671 IUPAC Name: 5-(2-methyl-4-nitrophenyl)furan-2-carbonyl chloride SMILES: CC1=C(C=CC(=C1)[N+]([O-])=O)C1=CC=C(O1)C(Cl)=O

PubChem CID 4484671
CAS 381178-60-5
Molecular Weight (g/mol) 265.65
MDL Number MFCD02257980
SMILES CC1=C(C=CC(=C1)[N+]([O-])=O)C1=CC=C(O1)C(Cl)=O
Synonym 5-2-methyl-4-nitrophenyl furan-2-carbonyl chloride,acmc-1ctfv,2-furancarbonylchloride, 5-2-methyl-4-nitrophenyl,5-2-methyl-4-nitro-phenyl-furan-2-carbonyl chloride
IUPAC Name 5-(2-methyl-4-nitrophenyl)furan-2-carbonyl chloride
InChI Key VBNSSVYGFDMJIZ-UHFFFAOYSA-N
Molecular Formula C12H8ClNO4