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| IUPAC Name: | 4-(trifluoromethyl)benzenethiol |
| Description: | 4-(trifluoromethyl)thiophenol (CAS# 825-83-2) is commonly involved with reductive dehalogenation reactions making it a useful reagent. |
| Molecular Weight: | 178.17 |
| Molecular Formula: | C7H5F3S |
| Canonical SMILES: | C1=CC(=CC=C1C(F)(F)F)S |
| InChI: | InChI=1S/C7H5F3S/c8-7(9,10)5-1-3-6(11)4-2-5/h1-4,11H |
| InChI Key: | WCMLRSZJUIKVCW-UHFFFAOYSA-N |
| Boiling Point: | 66-68 °C / 15 mmHg |
| Purity: | 98 % |
| Density: | 1.3 g/mL at 25 °C |
| Appearance: | Colorless to light yellow liquid |
| MDL: | MFCD00042320 |
| LogP: | 2.99410 |
| Refractive Index: | 1.4920-1.4940 |
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