HuagongsheHuagongshe Chemistry Print Report · For research reference only
4-nitrophenyl N-(3-trifluoromethylphenyl)carbamate
Identifiers & Physical Properties
| Molecular formula | C14H9F3N2O4 |
|---|---|
| Average molar mass | 326.23 g/mol |
| SMILES | O=C(Nc1cccc(C(F)(F)F)c1)Oc1ccc([N+](=O)[O-])cc1 |
| InChIKey | WCRZZCRCVVAPNH-UHFFFAOYSA-N |
| PubChem CID | 19081325 |
Chemical & Physical Properties
| XLogP | 4.1 |
|---|---|
| Topological polar surface area | 84.2 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 7 |
| Rotatable bonds | 3 |
| Heavy atoms | 23 |
| Formal charge | 0 |
| Complexity | 431 |