n-Cyano-4-nitrobenzamide
N-cyano-4-nitrobenzamide
Also Known As: n-cyano-4-nitrobenzamide|4-Nitro-N-cyanobenzamide|J3.263.964J
CAS: 4874-85-5
| Molecular Formula | C8H5N3O3 |
|---|---|
| Molecular Weight | 191.0331 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 98.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 191.0331 |
| Monoisotopic Mass | 191.0331 |
| Heavy Atoms | 14 |
| Complexity | 280.0 |
Chemical Identifiers
| CAS Number | 4874-85-5 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)NC#N)[N+](=O)[O-] |
| InChIKey | POFXLVUXMZFIFR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Dyes & Pigments (5 patents)
Heterocyclic Building Blocks (1 patents)
Organic Building Blocks (2 patents)
Textile Chemicals (6 patents)
Product Overview
n-Cyano-4-nitrobenzamide (CAS 4874-85-5), with molecular formula C8H5N3O3 and molecular weight 191.0331 g/mol. IUPAC: N-cyano-4-nitrobenzamide.
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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