| CAS Number | 1849313-27-4 |
| Catalog Number | AG01DZ4M |
| Chemical Name | 2-[(trifluoromethyl)sulfanyl]-1,3,4-thiadiazole |
| IUPAC Name | 2-(trifluoromethylsulfanyl)-1,3,4-thiadiazole |
| InChI | InChI=1S/C3HF3N2S2/c4-3(5,6)10-2-8-7-1-9-2/h1H |
| InChI Key | WYAKJDRROWOPHP-UHFFFAOYSA-N |
| MDL Number | MFCD30333425 |
| Molecular Formula | C3HF3N2S2 |
| Molecular Weight | 186.1786 |
| SMILES | FC(SC1SC=NN=1)(F)F |
| Synonyms | 2-[(trifluoromethyl)sulfanyl]-1,3,4-thiadiazole,
1849313-27-4,
SCHEMBL14972369,
|
| Complexity | 117 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 185.953g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 186.17g/mol |
| Monoisotopic Mass | 185.953g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 79.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number