N-(3-Chlorophenyl)-2,4,6-trinitroaniline
N-(3-chlorophenyl)-2,4,6-trinitroaniline
Also Known As: (3-chloro-phenyl)-picryl-amine|3'-Chloro-2,4,6-trinitrodiphenylamine|N-(3-Chlorophenyl)-2,4,6-trinitroaniline|3 -Chloro-2,4,6-trinitrodiphenylamine|J1.427.483I|N-(3-Chlorophenyl)-2,4,6-trinitroaniline #|N-(3-Chlorophenyl)-2,4,6-trinitrobenzenamine
CAS: 42499-14-9
| Molecular Formula | C12H7ClN4O6 |
|---|---|
| Molecular Weight | 338.0054 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 149.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 338.0054 |
| Monoisotopic Mass | 338.0054 |
| Heavy Atoms | 23 |
| Complexity | 452.0 |
Chemical Identifiers
| CAS Number | 42499-14-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)NC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | GSRLJZRKZZUSPA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Agrochemicals (2 patents)
Product Overview
N-(3-Chlorophenyl)-2,4,6-trinitroaniline (CAS 42499-14-9), with molecular formula C12H7ClN4O6 and molecular weight 338.0054 g/mol. IUPAC: N-(3-chlorophenyl)-2,4,6-trinitroaniline.
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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