Trifluoromethylthiocyanate
trifluoromethyl thiocyanate
Also Known As: Trifluoromethylthiocyanate|trifluoromethyl thiocyanate|Thiocyanic acid, trifluoromethyl ester
CAS: 690-24-4
| Molecular Formula | C2F3NS |
|---|---|
| Molecular Weight | 126.97035 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 49.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 126.97035 |
| Monoisotopic Mass | 126.97035 |
| Heavy Atoms | 7 |
| Complexity | 97.0 |
Chemical Identifiers
| CAS Number | 690-24-4 |
|---|---|
| SMILES | C(#N)SC(F)(F)F |
| InChIKey | IWJODGXJDSWIHQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Electronic Chemicals (3 patents)
Heterocyclic Building Blocks (4 patents)
Pharmaceutical Intermediates (4 patents)
Product Overview
Trifluoromethylthiocyanate (CAS 690-24-4), with molecular formula C2F3NS and molecular weight 126.97035 g/mol. IUPAC: trifluoromethyl thiocyanate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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