| CAS Number | 1354953-22-2 |
| Catalog Number | AG019SVS(AGN-PC-0WO7BJ) |
| Chemical Name | Oxan-4-ylmethanesulfonyl fluoride |
| IUPAC Name | oxan-4-ylmethanesulfonyl fluoride |
| InChI | InChI=1S/C6H11FO3S/c7-11(8,9)5-6-1-3-10-4-2-6/h6H,1-5H2 |
| InChI Key | DWTWFCFQDGUAGQ-UHFFFAOYSA-N |
| MDL Number | MFCD20731142 |
| Molecular Formula | C6H11FO3S |
| Molecular Weight | 182.2131 |
| SMILES | FS(CC1CCOCC1)(=O)=O |
| Synonyms | oxan-4-ylmethanesulfonyl fluoride,
1354953-22-2,
(oxan-4-yl)methanesulfonyl fluoride,
(Tetrahydro-2H-pyran-4-yl)methanesulfonyl fluoride,
AKOS026728465,
ZINC100651770,
ES-2141,
NE21344,
Z2492396246,
|
| Complexity | 200 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 182.041g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 182.209g/mol |
| Monoisotopic Mass | 182.041g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 51.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number