| CAS Number | 956324-88-2 |
| Catalog Number | AG018O3K(AGN-PC-0WOTTB) |
| Chemical Name | 3-(2-Methylpropyl)piperidine hydrochloride |
| IUPAC Name | 3-(2-methylpropyl)piperidine;hydrochloride |
| InChI | InChI=1S/C9H19N.ClH/c1-8(2)6-9-4-3-5-10-7-9;/h8-10H,3-7H2,1-2H3;1H |
| InChI Key | AKDLRDKTNUZNQC-UHFFFAOYSA-N |
| MDL Number | MFCD22375319 |
| Molecular Formula | C9H20ClN |
| Molecular Weight | 177.7148 |
| SMILES | Cl.CC(CC1CNCCC1)C |
| Synonyms | 3-(2-methylpropyl)piperidine hydrochloride,
956324-88-2,
SCHEMBL991509,
3-isobutylpiperidine hydrochloride,
AKDLRDKTNUZNQC-UHFFFAOYSA-N,
AKOS026743372,
MCULE-6586488336,
NE16882,
RP23914,
F2167-1841,
Z1415893887,
3-(2-methylpropyl)piperidine;hydrochloride,
956429-47-3,
|
| Complexity | 88.7 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 177.128g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 177.716g/mol |
| Monoisotopic Mass | 177.128g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number