| CAS Number | 365428-34-8 |
| Catalog Number | AG019T0S(AGN-PC-03MBRO) |
| Chemical Name | 3,3,3-Trifluoropropanethioamide |
| IUPAC Name | 3,3,3-trifluoropropanethioamide |
| InChI | InChI=1S/C3H4F3NS/c4-3(5,6)1-2(7)8/h1H2,(H2,7,8) |
| InChI Key | MOHVUNKPSQGYFW-UHFFFAOYSA-N |
| MDL Number | MFCD09804631 |
| Molecular Formula | C3H4F3NS |
| Molecular Weight | 143.1308 |
| SMILES | NC(CC(F)(F)F)=S |
| Synonyms | 3,3,3-TRIFLUOROPROPANETHIOAMIDE,
365428-34-8,
SCHEMBL2142141,
CTK4H6601,
DTXSID40623515,
MOHVUNKPSQGYFW-UHFFFAOYSA-N,
ZINC19264935,
AKOS000148298,
AB52631,
NE56689,
3,3,3-TRIFLUOROTHIOPROPIONAMIDE,
3,3,3-Trifluoropropanethioamide, AldrichCPR,
|
| Complexity | 97.2 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 143.002g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 143.127g/mol |
| Monoisotopic Mass | 143.002g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 58.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number