HuagongsheHuagongshe Chemistry Print Report · For research reference only
m-Trifluoromethyl-2-formylbenzyl cyanide
Identifiers & Physical Properties
| Molecular formula | C10H6F3NO |
|---|---|
| Average molar mass | 213.16 g/mol |
| Monoisotopic mass | 213.0401483 g/mol |
| SMILES | N#CCc1cccc(C(F)(F)F)c1C=O |
| InChIKey | PRUSWLVZTHLBEB-UHFFFAOYSA-N |
| PubChem CID | 20249155 |
Chemical & Physical Properties
| XLogP | 1.9 |
|---|---|
| Topological polar surface area | 40.9 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 5 |
| Rotatable bonds | 2 |
| Heavy atoms | 15 |
| Formal charge | 0 |
| Complexity | 278 |