Nitrotoluenes

Alfa Aesar™ 2-Nitro-m-xylene, 99%

CAS: 81-20-9 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.165 MDL Number: MFCD00007181 InChI Key: HDFQKJQEWGVKCQ-UHFFFAOYSA-N Synonym: 1,3-dimethyl-2-nitro-benzene PubChem CID: 6672 IUPAC Name: 1,3-dimethyl-2-nitrobenzene SMILES: CC1=C(C(=CC=C1)C)[N+](=O)[O-]

Alfa Aesar™ 4-Fluoro-3-nitrotoluene, 98%

CAS: 446-11-7 Molecular Formula: C7H6FNO2 Molecular Weight (g/mol): 155.128 MDL Number: MFCD00007060 InChI Key: OORBDHOQLZRIQR-UHFFFAOYSA-N Synonym: 1-fluoro-4-methyl-2-nitro-benzene PubChem CID: 136287 IUPAC Name: 1-fluoro-4-methyl-2-nitrobenzene SMILES: CC1=CC(=C(C=C1)F)[N+](=O)[O-]

2-Nitrotoluene, 99+% Alfa Aesar™

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

4-Nitrotoluene, 99%, ACROS Organics™

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

Alfa Aesar™ 4-Methyl-2-nitroaniline, 98+%

CAS: 89-62-3 Molecular Formula: C7H8N2O2 Molecular Weight (g/mol): 152.153 MDL Number: MFCD00007907 InChI Key: DLURHXYXQYMPLT-UHFFFAOYSA-N Synonym: 2-nitro-4-methylaniline PubChem CID: 6978 ChEBI: CHEBI:66920 IUPAC Name: 4-methyl-2-nitroaniline SMILES: CC1=CC(=C(C=C1)N)[N+](=O)[O-]

2-Nitrotoluene 99.0+%, TCI America™

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

4-Methyl-2-nitroaniline 99%, ACROS Organics™

CAS: 89-62-3 Molecular Formula: C7H8N2O2 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00007907 InChI Key: DLURHXYXQYMPLT-UHFFFAOYSA-N Synonym: 2-nitro-4-methylaniline PubChem CID: 6978 ChEBI: CHEBI:66920 IUPAC Name: 4-methyl-2-nitroaniline SMILES: CC1=CC(=C(C=C1)N)[N+](=O)[O-]

2,6-Dimethylnitrobenzene 99.0+%, TCI America™

CAS: 81-20-9 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.165 MDL Number: MFCD00007181 InChI Key: HDFQKJQEWGVKCQ-UHFFFAOYSA-N Synonym: 1,3-dimethyl-2-nitro-benzene PubChem CID: 6672 IUPAC Name: 1,3-dimethyl-2-nitrobenzene SMILES: CC1=C(C(=CC=C1)C)[N+](=O)[O-]

4-Nitrotoluene 99.0+%, TCI America™

CAS: 99-99-0 Molecular Formula: C7H7NO2 Molecular Weight (g/mol): 137.138 MDL Number: MFCD00007366 InChI Key: ZPTVNYMJQHSSEA-UHFFFAOYSA-N Synonym: 4-methylnitrobenzene PubChem CID: 7473 ChEBI: CHEBI:35227 IUPAC Name: 1-methyl-4-nitrobenzene SMILES: CC1=CC=C(C=C1)[N+](=O)[O-]

4-Bromo-2-nitrotoluene 98.0+%, TCI America™

CAS: 60956-26-5 Molecular Formula: C7H6BrNO2 Molecular Weight (g/mol): 216.034 MDL Number: MFCD00041243 InChI Key: KZNXALJXBRSMFL-UHFFFAOYSA-N Synonym: 2-nitro-4-bromotoluene PubChem CID: 123546 IUPAC Name: 4-bromo-1-methyl-2-nitrobenzene SMILES: CC1=C(C=C(C=C1)Br)[N+](=O)[O-]

4-Methyl-3-nitroaniline 98.0+%, TCI America™

CAS: 119-32-4 Molecular Formula: C7H8N2O2 Molecular Weight (g/mol): 152.153 MDL Number: MFCD00007910 InChI Key: GDIIPKWHAQGCJF-UHFFFAOYSA-N Synonym: 2-nitro-4-aminotoluene PubChem CID: 8390 ChEBI: CHEBI:81670 IUPAC Name: 4-methyl-3-nitroaniline SMILES: CC1=C(C=C(C=C1)N)[N+](=O)[O-]

2,4,6-Trinitrotoluene, SPEX CertiPrep™ Available on GSA/VA Contract for Federal Government customers only.

CAS: 118-96-7 Molecular Formula: C7H5N3O6 Molecular Weight (g/mol): 227.132 InChI Key: SPSSULHKWOKEEL-UHFFFAOYSA-N PubChem CID: 8376 ChEBI: CHEBI:46053 IUPAC Name: 2-methyl-1,3,5-trinitrobenzene SMILES: CC1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Alfa Aesar™ 2-Methyl-5-nitroaniline, 98+%

CAS: 99-55-8 Molecular Formula: C7H8N2O2 Molecular Weight (g/mol): 152.153 MDL Number: MFCD00007741 InChI Key: DSBIJCMXAIKKKI-UHFFFAOYSA-N Synonym: 2-amino-4-nitrotoluene PubChem CID: 7444 ChEBI: CHEBI:66891 IUPAC Name: 2-methyl-5-nitroaniline SMILES: CC1=C(C=C(C=C1)[N+](=O)[O-])N

Alfa Aesar™ 2-(2-Methyl-6-nitrophenyl)acetic acid, 95%

CAS: 23876-18-8 Molecular Formula: C9H9NO4 Molecular Weight (g/mol): 195.174 MDL Number: MFCD00066313 InChI Key: WFKNETIJXXWRHO-UHFFFAOYSA-N Synonym: 2-2-methyl-6-nitrophenyl acetic acid PubChem CID: 675115 SMILES: CC1=C(C(=CC=C1)[N+](=O)[O-])CC(=O)O

Alfa Aesar™ 2-Fluoro-4-nitrotoluene, 98%

CAS: 1427-07-2 Molecular Formula: C7H6FNO2 Molecular Weight (g/mol): 155.128 MDL Number: MFCD00007199 InChI Key: WIQISTBTOQNVCE-UHFFFAOYSA-N Synonym: 1-methyl-2-fluoro-4-nitrobenzene PubChem CID: 74025 IUPAC Name: 2-fluoro-1-methyl-4-nitrobenzene SMILES: CC1=C(C=C(C=C1)[N+](=O)[O-])F

2-Bromo-5-nitrotoluene, 99%, ACROS Organics™

CAS: 7149-70-4 Molecular Formula: C7H6BrNO2 Molecular Weight (g/mol): 216.034 MDL Number: MFCD00007281 InChI Key: HIMGPQVBNICCGL-UHFFFAOYSA-N Synonym: 2-bromo-5-nitrotoluene PubChem CID: 251672 IUPAC Name: 1-bromo-2-methyl-4-nitrobenzene SMILES: CC1=C(C=CC(=C1)[N+](=O)[O-])Br

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-borono-4-nitrotoluene PubChem CID: 2773513 IUPAC Name: (2-methyl-5-nitrophenyl)boronic acid SMILES: B(C1=C(C=CC(=C1)[N+](=O)[O-])C)(O)O

Alfa Aesar™ 2-Chloro-4-fluoro-5-nitrotoluene, 97%

CAS: 112108-73-3 Molecular Formula: C7H5ClFNO2 Molecular Weight (g/mol): 189.57 MDL Number: MFCD11110549 InChI Key: YXVJHZWHPLOEAP-UHFFFAOYSA-N Synonym: 1-chloranyl-5-fluoranyl-2-methyl-4-nitro-benzene PubChem CID: 10103979 IUPAC Name: 1-chloro-5-fluoro-2-methyl-4-nitrobenzene SMILES: CC1=CC(=C(C=C1Cl)F)[N+](=O)[O-]

Alfa Aesar™ 4-Methyl-2-nitrophenyl isothiocyanate, 95%

CAS: 17614-74-3 Molecular Formula: C8H6N2O2S Molecular Weight (g/mol): 194.208 MDL Number: MFCD00041248 InChI Key: CUQUTWSUXWDJKF-UHFFFAOYSA-N Synonym: # PubChem CID: 140258 IUPAC Name: 1-isothiocyanato-4-methyl-2-nitrobenzene SMILES: CC1=CC(=C(C=C1)N=C=S)[N+](=O)[O-]

2-Nitrotoluene, 99+%, ACROS Organics™

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

Alfa Aesar™ 4-Chloro-2-nitrotoluene, 99%

CAS: 89-59-8 Molecular Formula: C7H6ClNO2 Molecular Weight (g/mol): 171.58 MDL Number: MFCD00007215 InChI Key: SQFLFRQWPBEDHM-UHFFFAOYSA-N Synonym: 2-nitro-4-chlorotoluene PubChem CID: 6975 IUPAC Name: 4-chloro-1-methyl-2-nitrobenzene SMILES: CC1=C(C=C(C=C1)Cl)[N+](=O)[O-]

Alfa Aesar™ 3-Fluoro-2-nitrotoluene, 96%

CAS: 3013-27-2 Molecular Formula: C7H6FNO2 Molecular Weight (g/mol): 155.128 MDL Number: MFCD08458093 InChI Key: JSXAJLMUBSEJFF-UHFFFAOYSA-N Synonym: 1-fluoro-3-methyl-2-nitro-benzene PubChem CID: 19773803 IUPAC Name: 1-fluoro-3-methyl-2-nitrobenzene SMILES: CC1=C(C(=CC=C1)F)[N+](=O)[O-]

Alfa Aesar™ 2-Iodo-4-nitrotoluene, 97%

CAS: 7745-92-8 Molecular Formula: C7H6INO2 Molecular Weight (g/mol): 263.034 MDL Number: MFCD00024329 InChI Key: BUQSRXQJUZTIEW-UHFFFAOYSA-N Synonym: 2-iodo-1-methyl-4-nitro-benzene PubChem CID: 82188 IUPAC Name: 2-iodo-1-methyl-4-nitrobenzene SMILES: CC1=C(C=C(C=C1)[N+](=O)[O-])I

Alfa Aesar™ 4-Fluoro-2-nitrotoluene, 98%

CAS: 446-10-6 Molecular Formula: C7H6FNO2 Molecular Weight (g/mol): 155.128 MDL Number: MFCD00007200 InChI Key: SKWTUNAAJNDEIK-UHFFFAOYSA-N Synonym: 2-nitro-4-fluorotoluene PubChem CID: 67965 IUPAC Name: 4-fluoro-1-methyl-2-nitrobenzene SMILES: CC1=C(C=C(C=C1)F)[N+](=O)[O-]

Alfa Aesar™ 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: 2-nitrotoluene-4-boronic 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

Alfa Aesar™ 5-(2-Methyl-4-nitrophenyl)furan-2-carbonyl chloride

CAS: 381178-60-5 Molecular Formula: C12H8ClNO4 Molecular Weight (g/mol): 265.649 MDL Number: MFCD02257980 InChI Key: VBNSSVYGFDMJIZ-UHFFFAOYSA-N Synonym: 2-furancarbonylchloride, 5-2-methyl-4-nitrophenyl PubChem CID: 4484671 IUPAC Name: 5-(2-methyl-4-nitrophenyl)furan-2-carbonyl chloride SMILES: CC1=C(C=CC(=C1)[N+](=O)[O-])C2=CC=C(O2)C(=O)Cl

Alfa Aesar™ 2-Methyl-5-nitrophenyl isocyanate, 97%

CAS: 13471-68-6 Molecular Formula: C8H6N2O3 Molecular Weight (g/mol): 178.147 MDL Number: MFCD00014718 InChI Key: PQFOUIMVTGBFRN-UHFFFAOYSA-N Synonym: 2-methyl-5-nitrobenzenisocyanate PubChem CID: 292609 IUPAC Name: 2-isocyanato-1-methyl-4-nitrobenzene SMILES: CC1=C(C=C(C=C1)[N+](=O)[O-])N=C=O

4-Methyl-3-nitroaniline, 97%, ACROS Organics™

CAS: 119-32-4 Molecular Formula: C7H8N2O2 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00007910 InChI Key: GDIIPKWHAQGCJF-UHFFFAOYSA-N Synonym: 2-nitro-4-aminotoluene PubChem CID: 8390 ChEBI: CHEBI:81670 IUPAC Name: 4-methyl-3-nitroaniline SMILES: CC1=C(C=C(C=C1)N)[N+](=O)[O-]

Alfa Aesar™ 2-Fluoro-3-nitrotoluene, 98%

CAS: 437-86-5 Molecular Formula: C7H6FNO2 Molecular Weight (g/mol): 155.128 MDL Number: MFCD03412242 InChI Key: NBCNUIXYBLFJMI-UHFFFAOYSA-N Synonym: 1-methyl-2-fluoro-3-nitro-benzene PubChem CID: 13470957 IUPAC Name: 2-fluoro-1-methyl-3-nitrobenzene SMILES: CC1=C(C(=CC=C1)[N+](=O)[O-])F

Alfa Aesar™ 4-Iodo-2-nitrotoluene, 97%

CAS: 41252-97-5 Molecular Formula: C7H6INO2 Molecular Weight (g/mol): 263.034 MDL Number: MFCD00051090 InChI Key: QLMRDNPXYNJQMQ-UHFFFAOYSA-N Synonym: 2-nitro-4-iodotoluene PubChem CID: 170481 IUPAC Name: 4-iodo-1-methyl-2-nitrobenzene SMILES: CC1=C(C=C(C=C1)I)[N+](=O)[O-]

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