| CAS Number | 1343308-43-9 |
| Catalog Number | AG01A1U0(AGN-PC-0WO868) |
| Chemical Name | 3-chloro-1-methanesulfonylpiperidine |
| IUPAC Name | 3-chloro-1-methylsulfonylpiperidine |
| InChI | InChI=1S/C6H12ClNO2S/c1-11(9,10)8-4-2-3-6(7)5-8/h6H,2-5H2,1H3 |
| InChI Key | NKOVXJSSXLYQAL-UHFFFAOYSA-N |
| MDL Number | MFCD18351163 |
| Molecular Formula | C6H12ClNO2S |
| Molecular Weight | 197.683 |
| SMILES | CS(N1CC(Cl)CCC1)(=O)=O |
| Synonyms | 3-chloro-1-methanesulfonylpiperidine,
1343308-43-9,
AKOS012703921,
NE24559,
|
| Complexity | 221 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 197.028g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 197.677g/mol |
| Monoisotopic Mass | 197.028g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 45.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number