RefChem:1062002
2-piperidin-1-ium-1-ylethyl 2-hydroxy-2,3-diphenylpropanoate chloride
Also Known As: AC1L1PYG|AC1Q1SKQ|RefChem:1062002|alpha-Benzylmandelic acid 2-piperidinoethyl ester hydrochloride|2-(1-Piperidyl)ethyl benzylphenylglycolate hydrochloride|MANDELIC ACID, alpha-BENZYL-, 2-PIPERIDINOETHYL ESTER, HYDROCHLORIDE|1-{2-[(2-hydroxy-2,3-diphenylpropanoyl)oxy]ethyl}piperidinium chloride|2-piperidin-1-ium-1-ylethyl 2-hydroxy-2,3-diphenylpropanoate chloride|2-(Piperidin-1-yl)ethyl 2-hydroxy-2,3-diphenylpropanoate--hydrogen chloride (1/1)
| Molecular Formula | C22H28ClNO3 |
|---|---|
| Molecular Weight | 389.17578 g/mol |
| LogP | -1.27 |
| Topological Polar Surface Area | 50.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 389.17578 |
| Heavy Atoms | 27 |
| Complexity | 689.2 |
Chemical Identifiers
| CAS Number | 101756-47-2 |
|---|---|
| SMILES | C1CC[NH+](CC1)CCOC(=O)C(CC2=CC=CC=C2)(C3=CC=CC=C3)O.[Cl-] |
Product Overview
RefChem:1062002 (CAS 101756-47-2), with molecular formula C22H28ClNO3 and molecular weight 389.17578 g/mol. IUPAC: 2-piperidin-1-ium-1-ylethyl 2-hydroxy-2,3-diphenylpropanoate chloride.
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