| CAS Number | 1934960-78-7 |
| Catalog Number | AG01BDJY |
| Chemical Name | (6,6-dimethyloxan-2-yl)methanesulfonyl chloride |
| IUPAC Name | (6,6-dimethyloxan-2-yl)methanesulfonyl chloride |
| InChI | InChI=1S/C8H15ClO3S/c1-8(2)5-3-4-7(12-8)6-13(9,10)11/h7H,3-6H2,1-2H3 |
| InChI Key | OSVQXXNDTJPXDR-UHFFFAOYSA-N |
| MDL Number | MFCD30730393 |
| Molecular Formula | C8H15ClO3S |
| Molecular Weight | 226.7209 |
| SMILES | CC1(OC(CS(Cl)(=O)=O)CCC1)C |
| Synonyms | (6,6-dimethyloxan-2-yl)methanesulfonyl chloride,
1934960-78-7,
|
| Complexity | 266 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 226.043g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 226.715g/mol |
| Monoisotopic Mass | 226.043g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 51.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
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