| CAS Number | 953747-88-1 |
| Catalog Number | AG01AH0W(AGN-PC-0WO5T0) |
| Chemical Name | 1-amino-3-(4-methylpiperidin-1-yl)propan-2-ol |
| IUPAC Name | 1-amino-3-(4-methylpiperidin-1-yl)propan-2-ol |
| InChI | InChI=1S/C9H20N2O/c1-8-2-4-11(5-3-8)7-9(12)6-10/h8-9,12H,2-7,10H2,1H3 |
| InChI Key | YGYKZDYJRMQTLF-UHFFFAOYSA-N |
| MDL Number | MFCD09735090 |
| Molecular Formula | C9H20N2O |
| Molecular Weight | 172.2679 |
| SMILES | CC1CCN(CC(CN)O)CC1 |
| Synonyms | 1-amino-3-(4-methylpiperidin-1-yl)propan-2-ol,
953747-88-1,
AC1Q2R68,
CTK7E3217,
SBB076983,
AKOS000143326,
AKOS016050762,
MCULE-7247166953,
NE44978,
3-amino-1-(4-methylpiperidyl)propan-2-ol,
EN300-73382,
Z1266933821,
|
| Complexity | 122 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 172.158g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 172.272g/mol |
| Monoisotopic Mass | 172.158g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 49.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number