4-Amino-2-nitrobenzonitrile
4-amino-2-nitrobenzonitrile
Also Known As: 4-Amino-2-nitrobenzonitrile|4-amino-2-nitro-benzonitrile|Benzonitrile, 4-amino-2-nitro-
CAS: 72115-07-2
| Molecular Formula | C7H5N3O2 |
|---|---|
| Molecular Weight | 163.03818 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 95.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 163.03818 |
| Monoisotopic Mass | 163.03818 |
| Heavy Atoms | 12 |
| Complexity | 227.0 |
Chemical Identifiers
| CAS Number | 72115-07-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1N)[N+](=O)[O-])C#N |
| InChIKey | VJEWYKBLQBJAME-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Dyes & Pigments (8 patents)
Heterocyclic Building Blocks (3 patents)
Textile Chemicals (10 patents)
Product Overview
4-Amino-2-nitrobenzonitrile (CAS 72115-07-2), with molecular formula C7H5N3O2 and molecular weight 163.03818 g/mol. IUPAC: 4-amino-2-nitrobenzonitrile.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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