| CAS Number | 1803596-85-1 |
| Catalog Number | AG01AM2D |
| Chemical Name | {bicyclo[2.2.2]octan-1-yl}methanesulfonyl chloride |
| IUPAC Name | 1-bicyclo[2.2.2]octanylmethanesulfonyl chloride |
| InChI | InChI=1S/C9H15ClO2S/c10-13(11,12)7-9-4-1-8(2-5-9)3-6-9/h8H,1-7H2 |
| InChI Key | WFNMTXBKSKVCOM-UHFFFAOYSA-N |
| MDL Number | MFCD31567007 |
| Molecular Formula | C9H15ClO2S |
| Molecular Weight | 222.7322 |
| SMILES | C1CC2(CCC1CC2)CS(=O)(=O)Cl |
| Synonyms | {bicyclo[2.2.2]octan-1-yl}methanesulfonyl chloride,
1803596-85-1,
ZINC238856556,
|
| Complexity | 270 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 222.048g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 222.727g/mol |
| Monoisotopic Mass | 222.048g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 42.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number