| CAS Number | 928322-40-1 |
| Catalog Number | AG01AA2K |
| Chemical Name | 2-(4-Hydroxypiperidin-1-yl)-2-phenylacetic acid hydrochloride |
| IUPAC Name | 2-(4-hydroxypiperidin-1-yl)-2-phenylacetic acid;hydrochloride |
| InChI | InChI=1S/C13H17NO3.ClH/c15-11-6-8-14(9-7-11)12(13(16)17)10-4-2-1-3-5-10;/h1-5,11-12,15H,6-9H2,(H,16,17);1H |
| InChI Key | RIHZGNJVXMZYAO-UHFFFAOYSA-N |
| MDL Number | MFCD16817546 |
| Molecular Formula | C13H18ClNO3 |
| Molecular Weight | 271.7399 |
| SMILES | Cl.OC1CCN(C(C2=CC=CC=C2)C(O)=O)CC1 |
| Synonyms | 2-(4-hydroxypiperidin-1-yl)-2-phenylacetic acid hydrochloride,
928322-40-1,
AC1Q3F87,
RIHZGNJVXMZYAO-UHFFFAOYSA-N,
AKOS030715217,
MCULE-9027437484,
NE16110,
EN300-66865,
Z1695906934,
(4-hydroxypiperidin-1-yl) (phenyl)acetic acid hydrochloride,
|
| Complexity | 255 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 271.098g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 271.741g/mol |
| Monoisotopic Mass | 271.098g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 60.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number