| CAS Number | 145349-17-3 |
| Catalog Number | AG01CA5H(AGN-PC-0NHZE9) |
| Chemical Name | 2-Fluoro-2-methylpropyl trifluoromethanesulfonate |
| IUPAC Name | (2-fluoro-2-methylpropyl) trifluoromethanesulfonate |
| InChI | InChI=1S/C5H8F4O3S/c1-4(2,6)3-12-13(10,11)5(7,8)9/h3H2,1-2H3 |
| InChI Key | OJFXAMILNHYNSV-UHFFFAOYSA-N |
| MDL Number | MFCD20483378 |
| Molecular Formula | C5H8F4O3S |
| Molecular Weight | 224.1738 |
| SMILES | O=S(C(F)(F)F)(OCC(C)(F)C)=O |
| Synonyms | 2-fluoro-2-methylpropyl trifluoromethanesulfonate,
145349-17-3,
Trifluoromethanesulfonic acid 2-fluoro-2-methylpropyl ester,
Methanesulfonic acid, trifluoro-, 2-fluoro-2-methylpropyl ester,
SCHEMBL1067286,
2-fluoro-2-methyl-propyltriflate,
OJFXAMILNHYNSV-UHFFFAOYSA-N,
AKOS028108846,
2Fluoro-2-methylpropyl trifluoromethanesulfonate,
(2-fluoro-2-methyl-propyl)trifluoromethanesulfonate,
trifluoro-methanesulfonic acid 2-fluoro-2-methyl-propyl ester,
|
| Complexity | 261 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 224.013g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 224.17g/mol |
| Monoisotopic Mass | 224.013g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 51.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number