Mandelic acid, alpha-cyclopentyl-, 1,3-dimethyl-4-piperidyl ester, hydrochloride
(1,3-dimethylpiperidin-1-ium-4-yl) 2-cyclopentyl-2-hydroxy-2-phenylacetate chloride
Also Known As: AC1L1PQY|AC1Q1SHL|RefChem:1088811|1,3-Dimethyl-4-piperidyl phenylcyclopentylglycolate hydrochloride|MANDELIC ACID, alpha-CYCLOPENTYL-, 1,3-DIMETHYL-4-PIPERIDYL ESTER, HYDROCHLORIDE|alpha-Cyclopentylmandelic acid 1,3-dimethyl-4-piperidyl ester hydrochloride|(1,3-dimethylpiperidin-1-ium-4-yl) 2-cyclopentyl-2-hydroxy-2-phenylacetate;chloride|4-{[cyclopentyl(hydroxy)phenylacetyl]oxy}-1,3-dimethylpiperidinium chloride|(1,3-dimethylpiperidin-1-ium-4-yl) 2-cyclopentyl-2-hydroxy-2-phenylacetate chloride|(1,3-dimethylpiperidin-1-ium-4-yl) 2-cyclopentyl-2-hydroxy-2-phenylacetate,chloride|(1,3-dimethylpiperidin-1-ium-4-yl)2-cyclopentyl-2-hydroxy-2-phenylacetate chloride
| Molecular Formula | C20H30ClNO3 |
|---|---|
| Molecular Weight | 367.1914 g/mol |
| LogP | -1.47 |
| Topological Polar Surface Area | 50.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 367.1914 |
| Heavy Atoms | 25 |
| Complexity | 561.3 |
Chemical Identifiers
| CAS Number | 101710-79-6 |
|---|---|
| SMILES | CC1C[NH+](CCC1OC(=O)C(C2CCCC2)(C3=CC=CC=C3)O)C.[Cl-] |
Product Overview
Mandelic acid, alpha-cyclopentyl-, 1,3-dimethyl-4-piperidyl ester, hydrochloride (CAS 101710-79-6), with molecular formula C20H30ClNO3 and molecular weight 367.1914 g/mol. IUPAC: (1,3-dimethylpiperidin-1-ium-4-yl) 2-cyclopentyl-2-hydroxy-2-phenylacetate chloride.
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