| CAS Number | 1446485-41-1 |
| Catalog Number | AG01BJ30 |
| Chemical Name | 2-(trifluoromethyl)thiomorpholine |
| IUPAC Name | 2-(trifluoromethyl)thiomorpholine |
| InChI | InChI=1S/C5H8F3NS/c6-5(7,8)4-3-9-1-2-10-4/h4,9H,1-3H2 |
| InChI Key | VDMYKWRTPIJCPI-UHFFFAOYSA-N |
| MDL Number | MFCD28361693 |
| Molecular Formula | C5H8F3NS |
| Molecular Weight | 171.1839 |
| SMILES | FC(C1SCCNC1)(F)F |
| Synonyms | 2-(trifluoromethyl)thiomorpholine,
1446485-41-1,
Thiomorpholine, 2-(trifluoromethyl)-,
|
| Complexity | 114 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 171.033g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 171.181g/mol |
| Monoisotopic Mass | 171.033g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number