IUPAC Name: | 2-amino-4-(trifluoromethyl)benzenethiol;hydrochloride |
Description: | 2-Amino-4-(trifluoromethyl)benzenethiol Hydrochloride can be used as reactant/reagent in preparation of fused benzo-diazepinones/oxazocinone/thiazapines/diazapines/diazocins/thiazine/indoles via CuI-L-proline catalyzed SN2 reaction. |
Molecular Weight: | 229.65 |
Molecular Formula: | C7H7ClF3NS |
Canonical SMILES: | C1=CC(=C(C=C1C(F)(F)F)N)S.Cl |
InChI: | InChI=1S/C7H6F3NS.ClH/c8-7(9,10)4-1-2-6(12)5(11)3-4;/h1-3,12H,11H2;1H |
InChI Key: | FIAGYDIJZOWVAB-UHFFFAOYSA-N |
Boiling Point: | 241.5 °C at 760 mmHg |
Density: | 1.401 g/cm3 |
Appearance: | White to light yellow crystal powder |
MDL: | MFCD00042600 |
LogP: | 3.95950 |
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