| CAS Number | 53749-89-6 |
| Catalog Number | AG01B8DD(AGN-PC-0OBY5O) |
| Chemical Name | Bis(2,2,2-trifluoroethyl) sulfite |
| IUPAC Name | bis(2,2,2-trifluoroethyl) sulfite |
| InChI | InChI=1S/C4H4F6O3S/c5-3(6,7)1-12-14(11)13-2-4(8,9)10/h1-2H2 |
| InChI Key | HVNOLEGWKGMONA-UHFFFAOYSA-N |
| MDL Number | MFCD28246477 |
| Molecular Formula | C4H4F6O3S |
| Molecular Weight | 246.1282 |
| NSC Number | 252924 |
| SMILES | FC(COS(OCC(F)(F)F)=O)(F)F |
| Synonyms | bis(2,2,2-trifluoroethyl) sulfite,
53749-89-6,
NSC252924,
AC1L7XIG,
SCHEMBL776840,
DTXSID00312357,
di(2,2,2-trifluoroethyl) sulfite,
ZINC5411115,
NSC-252924,
CID318171,
|
| Complexity | 178 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 245.979g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 10 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 246.123g/mol |
| Monoisotopic Mass | 245.979g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 54.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number