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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

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

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
4

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