[2-amino-4-(trifluoromethyl)phenyl]methanethiol--hydrogen chloride (1/1)
Chemical Structure Depiction of
[2-amino-4-(trifluoromethyl)phenyl]methanethiol--hydrogen chloride (1/1)
[2-amino-4-(trifluoromethyl)phenyl]methanethiol--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | Y507-2422 |
| Compound Name: | [2-amino-4-(trifluoromethyl)phenyl]methanethiol--hydrogen chloride (1/1) |
| Molecular Weight: | 243.67 |
| Molecular Formula: | C8 H8 F3 N S |
| Salt: | HCl |
| Smiles: | C(c1ccc(cc1N)C(F)(F)F)S |
| Stereo: | ACHIRAL |
| logP: | 3.0265 |
| logD: | 3.0235 |
| logSw: | -3.0197 |
| Hydrogen bond acceptors count: | 1 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 20.3345 |
| InChI Key: | MPTSYQSLGJKPSU-UHFFFAOYSA-N |