1-Azoniabicyclo[2.2.2]octan-3-yl 2-(hydroxymethyl)-2-phenylbutanoate chloride
1-azoniabicyclo[2.2.2]octan-3-yl 2-(hydroxymethyl)-2-phenylbutanoate chloride
Also Known As: AC1Q1SID|AC1L1O25|2-(Hydroxymethyl)-2-phenylbutyric acid 3-quinuclidinyl ester hydrochloride|BUTYRIC ACID, 2-(HYDROXYMETHYL)-2-PHENYL-, 3-QUINUCLIDINYL ESTER, HYDROCHLORIDE|1-azoniabicyclo[2.2.2]octan-3-yl 2-(hydroxymethyl)-2-phenylbutanoate chloride|3-{[2-(hydroxymethyl)-2-phenylbutanoyl]oxy}-1-azoniabicyclo[2.2.2]octane chloride
| Molecular Formula | C18H26ClNO3 |
|---|---|
| Molecular Weight | 339.16013 g/mol |
| LogP | -2.45 |
| Topological Polar Surface Area | 50.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 339.16013 |
| Heavy Atoms | 23 |
| Complexity | 510.3 |
Chemical Identifiers
| CAS Number | 100700-30-9 |
|---|---|
| SMILES | CCC(CO)(C1=CC=CC=C1)C(=O)OC2C[NH+]3CCC2CC3.[Cl-] |
Product Overview
1-Azoniabicyclo[2.2.2]octan-3-yl 2-(hydroxymethyl)-2-phenylbutanoate chloride (CAS 100700-30-9), with molecular formula C18H26ClNO3 and molecular weight 339.16013 g/mol. IUPAC: 1-azoniabicyclo[2.2.2]octan-3-yl 2-(hydroxymethyl)-2-phenylbutanoate chloride.
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