4-(2,4,6-Trinitrophenylamino)benzoic acid
4-(2,4,6-trinitroanilino)benzoic acid
Also Known As: 4-picraminobenzoic acid|4-(2,4,6-Trinitrophenylamino)benzoic acid|4-(2,4,6-trinitroanilino)benzoic acid|4-[(2,4,6-trinitrophenyl)amino]benzoic Acid|4-[(2,4,6-Trinitrophenyl)amino]benzoic acid anion|635-344-6
CAS: 7221-18-3
| Molecular Formula | C13H8N4O8 |
|---|---|
| Molecular Weight | 348.0342 g/mol |
| LogP | 2.853 |
| Topological Polar Surface Area | 178.75 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 348.0342 |
| Monoisotopic Mass | 348.0342 |
| Heavy Atoms | 25 |
| Complexity | 858.39716 |
Chemical Identifiers
| CAS Number | 7221-18-3 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)O)NC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
4-(2,4,6-Trinitrophenylamino)benzoic acid (CAS 7221-18-3), with molecular formula C13H8N4O8 and molecular weight 348.0342 g/mol. IUPAC: 4-(2,4,6-trinitroanilino)benzoic acid.
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.
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