| CAS Number | 1803585-98-9 |
| Catalog Number | AG00I01I(AGN-PC-0WCV40) |
| Chemical Name | 2-[2-(Methylsulfonyl)ethyl]piperidine hydrochloride |
| IUPAC Name | 2-(2-methylsulfonylethyl)piperidine;hydrochloride |
| InChI | InChI=1S/C8H17NO2S.ClH/c1-12(10,11)7-5-8-4-2-3-6-9-8;/h8-9H,2-7H2,1H3;1H |
| InChI Key | CKTLXPMSKXNHQN-UHFFFAOYSA-N |
| MDL Number | MFCD26793023 |
| Molecular Formula | C8H18ClNO2S |
| Molecular Weight | 227.7520 |
| SMILES | Cl.CS(CCC1NCCCC1)(=O)=O |
| Synonyms | 1803585-98-9,
2-[2-(METHYLSULFONYL)ETHYL]PIPERIDINE HYDROCHLORIDE,
2-(2-methanesulfonylethyl)piperidine hydrochloride,
MFCD26793023,
AKOS030235929,
2-[2-(methylsulfonyl)ethyl]piperidine HCl,
T5718,
F2167-0332,
Z2188172198,
2-(2-methylsulfonylethyl)piperidine;hydrochloride,
|
| Complexity | 218 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 227.075g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 227.747g/mol |
| Monoisotopic Mass | 227.075g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 54.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number