| CAS Number | 2091454-01-0 |
| Catalog Number | AG01BTTH |
| Chemical Name | {2-oxaspiro[4.4]nonan-3-yl}methanesulfonyl chloride |
| IUPAC Name | 2-oxaspiro[4.4]nonan-3-ylmethanesulfonyl chloride |
| InChI | InChI=1S/C9H15ClO3S/c10-14(11,12)6-8-5-9(7-13-8)3-1-2-4-9/h8H,1-7H2 |
| InChI Key | ZWYVSLBHRSYHQX-UHFFFAOYSA-N |
| MDL Number | MFCD31665812 |
| Molecular Formula | C9H15ClO3S |
| Molecular Weight | 238.7316 |
| SMILES | ClS(CC1OCC2(CCCC2)C1)(=O)=O |
| Synonyms | {2-oxaspiro[4.4]nonan-3-yl}methanesulfonyl chloride,
2091454-01-0,
|
| Complexity | 301 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 238.043g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 238.726g/mol |
| Monoisotopic Mass | 238.043g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 51.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
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