| CAS Number | 1016533-06-4 |
| Catalog Number | AG019UDM(AGN-PC-0WO0PM) |
| Chemical Name | 4-(3,5-Dimethylpiperidin-1-yl)butan-1-amine |
| IUPAC Name | 4-(3,5-dimethylpiperidin-1-yl)butan-1-amine |
| InChI | InChI=1S/C11H24N2/c1-10-7-11(2)9-13(8-10)6-4-3-5-12/h10-11H,3-9,12H2,1-2H3 |
| InChI Key | LPCNLOZVHDWVKT-UHFFFAOYSA-N |
| MDL Number | MFCD09807265 |
| Molecular Formula | C11H24N2 |
| Molecular Weight | 184.3217 |
| SMILES | CC1CN(CCCCN)CC(C)C1 |
| Synonyms | 4-(3,5-dimethylpiperidin-1-yl)butan-1-amine,
1016533-06-4,
AC1Q2QMA,
CTK7E8063,
AKOS000159652,
AKOS022420079,
MCULE-9556533709,
NE14482,
EN300-41324,
4-((3R,5S)-3,5-dimethylpiperidin-1-yl)butan-1-amine,
F2187-2343,
Z1695785889,
4-(3,5-dimethylpiperidin-1-yl)butan-1-amine, Mixture of diastereomers,
|
| Complexity | 126 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 184.194g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 184.327g/mol |
| Monoisotopic Mass | 184.194g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 29.3A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number