Mandelic acid, alpha-isopropyl-, 2-quinuclidinylmethyl ester, hydrochloride
1-azoniabicyclo[2.2.2]octan-2-ylmethyl 2-hydroxy-3-methyl-2-phenylbutanoate chloride
Also Known As: AC1L1PTP|RefChem:351935|AC1Q1SL3|2-Quinuclidinemethylene-alpha-isopropyl-alpha-phenylglycolate hydrochloride|MANDELIC ACID, alpha-ISOPROPYL-, 2-QUINUCLIDINYLMETHYL ESTER, HYDROCHLORIDE|1-Azoniabicyclo[2.2.2]octan-7-ylmethyl2-hydroxy-3-methyl-2-phenylbutanoate chloride|1-azoniabicyclo[2.2.2]octan-2-ylmethyl2-hydroxy-3-methyl-2-phenylbutanoate|1-azoniabicyclo[2.2.2]octan-2-ylmethyl 2-hydroxy-3-methyl-2-phenylbutanoate chloride|2-{[(2-hydroxy-3-methyl-2-phenylbutanoyl)oxy]methyl}-1-azoniabicyclo[2.2.2]octane chloride
| Molecular Formula | C19H28ClNO3 |
|---|---|
| Molecular Weight | 353.17578 g/mol |
| LogP | -1.86 |
| Topological Polar Surface Area | 50.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 353.17578 |
| Heavy Atoms | 24 |
| Complexity | 542.8 |
Chemical Identifiers
| CAS Number | 101711-03-9 |
|---|---|
| SMILES | CC(C)C(C1=CC=CC=C1)(C(=O)OCC2CC3CC[NH+]2CC3)O.[Cl-] |
Product Overview
Mandelic acid, alpha-isopropyl-, 2-quinuclidinylmethyl ester, hydrochloride (CAS 101711-03-9), with molecular formula C19H28ClNO3 and molecular weight 353.17578 g/mol. IUPAC: 1-azoniabicyclo[2.2.2]octan-2-ylmethyl 2-hydroxy-3-methyl-2-phenylbutanoate chloride.
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