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| IUPAC Name: | 2,2,2-trifluoroethylsulfanylmethylbenzene |
| Description: | Benzyl 2,2,2-trifluoroethyl sulfide (CAS# 77745-03-0) is a useful intermediate for the preparation of trifluoroethanesulfonic acid. |
| Molecular Weight: | 206.23 |
| Molecular Formula: | C9H9F3S |
| Canonical SMILES: | C1=CC=C(C=C1)CSCC(F)(F)F |
| InChI: | InChI=1S/C9H9F3S/c10-9(11,12)7-13-6-8-4-2-1-3-5-8/h1-5H,6-7H2 |
| InChI Key: | ZDVBYNCJCIYCFO-UHFFFAOYSA-N |
| Boiling Point: | 45-46 °C / 20 mmHg (lit.) |
| Density: | 1.222 g/cm3 |
| MDL: | MFCD00191786 |
| LogP: | 3.48210 |
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