| CAS Number | 329710-76-1 |
| Catalog Number | AG00CMQW(AGN-PC-0R8D0G) |
| Chemical Name | 2-(Trifluoromethoxy)ethyl trifluoromethanesulfonate |
| IUPAC Name | 2-(trifluoromethoxy)ethyl trifluoromethanesulfonate |
| InChI | InChI=1S/C4H4F6O4S/c5-3(6,7)13-1-2-14-15(11,12)4(8,9)10/h1-2H2 |
| InChI Key | XNNJMXBWUMKLRR-UHFFFAOYSA-N |
| MDL Number | MFCD22570641 |
| Molecular Formula | C4H4F6O4S |
| Molecular Weight | 262.1276 |
| SMILES | FC(OCCOS(C(F)(F)F)(=O)=O)(F)F |
| Synonyms | 2-(TRIFLUOROMETHOXY)ETHYL TRIFLUOROMETHANESULFONATE,
329710-76-1,
Trifluoromethanesulfonic acid 2-(trifluoromethoxy)ethyl ester,
SCHEMBL1191830,
DTXSID00442840,
XNNJMXBWUMKLRR-UHFFFAOYSA-N,
BBL102188,
MFCD22570641,
STL555987,
AKOS016008953,
ZINC100055321,
2-(trifluoromethoxy)ethyltrifluoro-methanesulfonate,
2-(trifluoromethoxy)ethyl trifluoromethanesulphonate,
Trifluoromethanesulfonic acid 2-trifluoromethoxy-ethyl ester,
Trifluoromethanesulfonic acid 2-trifluoromethoxyethyl ester,
Trifluoromethanesulfonic acid 2-trifluoromethoxyethyle ster,
Trifluoro-methanesulfonic acid 2-trifluoromethoxy-ethyl ester,
CID10635181,
1-(trifluoromethoxy)-2-(trifluoromethylsulfonyloxy)ethane,
|
| Complexity | 284 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 261.973g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 10 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 262.122g/mol |
| Monoisotopic Mass | 261.973g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 61A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number