HuagongsheHuagongshe Chemistry Print Report · For research reference only
4-(Trifluoromethyl)phenyl N,N-diethylcarbamate
Identifiers & Physical Properties
| CAS No. | 34857-71-1 |
|---|---|
| Molecular formula | C12H14F3NO2 |
| Average molar mass | 261.24 g/mol |
| Monoisotopic mass | 261.09766318 g/mol |
| SMILES | CCN(CC)C(=O)Oc1ccc(C(F)(F)F)cc1 |
| InChIKey | LOGFNVWEFALMBH-UHFFFAOYSA-N |
| PubChem CID | 85788198 |
| DTXSID | DTXSID001246726 |
Chemical & Physical Properties
| XLogP | 3.3 |
|---|---|
| Topological polar surface area | 29.5 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 5 |
| Rotatable bonds | 4 |
| Heavy atoms | 18 |
| Formal charge | 0 |
| Complexity | 269 |