| CAS Number | 1214119-76-2 |
| Catalog Number | AG019XFU(AGN-PC-0WO90U) |
| Chemical Name | 3-Methyl-2-(4-methylpiperidin-1-yl)butanoic acid hydrochloride |
| IUPAC Name | 3-methyl-2-(4-methylpiperidin-1-yl)butanoic acid;hydrochloride |
| InChI | InChI=1S/C11H21NO2.ClH/c1-8(2)10(11(13)14)12-6-4-9(3)5-7-12;/h8-10H,4-7H2,1-3H3,(H,13,14);1H |
| InChI Key | WYDLGTPGNHGFMS-UHFFFAOYSA-N |
| MDL Number | MFCD13196148 |
| Molecular Formula | C11H22ClNO2 |
| Molecular Weight | 235.7509 |
| SMILES | Cl.CC(C(C(O)=O)N1CCC(C)CC1)C |
| Synonyms | 3-methyl-2-(4-methylpiperidin-1-yl)butanoic acid hydrochloride,
1214119-76-2,
CTK6C2820,
AC1Q3910,
AKOS026728996,
MCULE-6892197322,
NE55066,
EN300-54874,
|
| Complexity | 196 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 235.134g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 235.752g/mol |
| Monoisotopic Mass | 235.134g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 40.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number