(Pyridin-2-yl)methyl 2-phenylbutanoate--hydrogen chloride (1/1)
pyridin-1-ium-2-ylmethyl 2-phenylbutanoate chloride
Also Known As: RefChem:1051037|AC1L211V|2-Pyridylmethyl alpha-phenylbutyrate hydrochloride|F 1172|pyridin-1-ium-2-ylmethyl 2-phenylbutanoate chloride|Methanol, 2-pyridyl-, alpha-phenylbutyrate, hydrochloride|Benzeneacetic acid, alpha-ethyl-, 2-pyridylmethyl ester hydrochloride|BUTYRIC ACID, alpha-PHENYL-, 2-PYRIDYLMETHYL ESTER, HYDROCHLORIDE|(Pyridin-2-yl)methyl 2-phenylbutanoate--hydrogen chloride (1/1)|Benzeneacetic acid, .alpha.-ethyl-, 2-pyridinylmethyl ester, hydrochloride
| Molecular Formula | C16H18ClNO2 |
|---|---|
| Molecular Weight | 291.1026 g/mol |
| LogP | -0.26 |
| Topological Polar Surface Area | 40.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 291.1026 |
| Heavy Atoms | 20 |
| Complexity | 516.5 |
Chemical Identifiers
| CAS Number | 42023-67-6 |
|---|---|
| SMILES | CCC(C1=CC=CC=C1)C(=O)OCC2=CC=CC=[NH+]2.[Cl-] |
Product Overview
(Pyridin-2-yl)methyl 2-phenylbutanoate--hydrogen chloride (1/1) (CAS 42023-67-6), with molecular formula C16H18ClNO2 and molecular weight 291.1026 g/mol. IUPAC: pyridin-1-ium-2-ylmethyl 2-phenylbutanoate chloride.
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