| CAS Number | 885275-65-0 |
| Catalog Number | AG00IF5A(AGN-PC-0WRA7I) |
| Chemical Name | 4,4,4-Trifluorobutyl trifluoromethanesulfonate |
| IUPAC Name | 4,4,4-trifluorobutyl trifluoromethanesulfonate |
| InChI | InChI=1S/C5H6F6O3S/c6-4(7,8)2-1-3-14-15(12,13)5(9,10)11/h1-3H2 |
| InChI Key | RBNDTPRHAUMXNY-UHFFFAOYSA-N |
| MDL Number | MFCD07784317 |
| Molecular Formula | C5H6F6O3S |
| Molecular Weight | 260.1548 |
| SMILES | FC(F)(F)CCCOS(=O)(=O)C(F)(F)F |
| Synonyms | 4,4,4-trifluorobutyl trifluoromethanesulfonate,
885275-65-0,
4,4,4-Trifluorobutyl trifluoromethanesulphonate,
SCHEMBL15608435,
CTK7B7127,
MFCD07784317,
SBB102271,
ZINC100037310,
DA-17991,
FT-0731239,
4,4,4-trifluorobutyl (trifluoromethyl)sulfonate,
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| Complexity | 283 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 259.994g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 9 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 260.15g/mol |
| Monoisotopic Mass | 259.994g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 51.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number