4-Methyl-3-nitrobenzonitrile
4-methyl-3-nitrobenzonitrile
Also Known As: 4-Methyl-3-nitrobenzonitrile|3-nitro-4-methylbenzonitrile|3-Nitro-p-tolunitrile|4-Cyano-2-nitrotoluene|2-NITRO-P-TOLUONITRILE|4-Methyl-3-nitro-benzonitrile|Benzonitrile, 4-methyl-3-nitro-|ACMC-209gtb|5-Cyano-2-methylnitrobenzene|4-methyl-3-nitrobenzenecarbonitrile|3-Nitro-4-methylbenzonitril|4-methyl-3-nitro benzonitrile|BEN166|Benzonitrile,4-methyl-3-nitro-|KS-00000NDJ|1-methyl-4-cyano-2-nitrobenzene|4-Methyl-3-nitrobenzonitrile, 97%|CN-108|AC-4101|CS-W002158|PS-5268
| Molecular Formula | C8H6N2O2 |
|---|---|
| Molecular Weight | 162.04292 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 69.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 162.04292 |
| Monoisotopic Mass | 162.04292 |
| Heavy Atoms | 12 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 939-79-7 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C#N)[N+](=O)[O-] |
| InChIKey | KOFBNBCOGKLUOM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Methyl-3-nitrobenzonitrile (CAS 939-79-7), with molecular formula C8H6N2O2 and molecular weight 162.04292 g/mol. IUPAC: 4-methyl-3-nitrobenzonitrile.
4-Methyl-3-nitrobenzonitrile is a custom synthesis product. We offer services from milligram to kilogram scale.
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