RefChem:335949
4-(diethylamino)but-2-ynyl 1-phenylcyclopentane-1-carboxylate;hydrochloride
Also Known As: Cyclopentanecarboxylic acid, 1-phenyl-, 4-(diethylamino)-2-butynyl ester, hydrochloride|1-Phenylcyclopentanecarboxylic acid 4-(diethylamino)-2-butynyl ester hydrochloride|4-(diethylamino)but-2-ynyl 1-phenylcyclopentane-1-carboxylate hydrochloride|4-(Diethylamino)but-2-yn-1-yl 1-phenylcyclopentane-1-carboxylate--hydrogen chloride (1/1)
CAS: 17781-95-2
| Molecular Formula | C20H28ClNO2 |
|---|---|
| Molecular Weight | 349.18085 g/mol |
| LogP | 3.8086 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 349.18085 |
| Monoisotopic Mass | 349.18085 |
| Heavy Atoms | 24 |
| Complexity | 429.0 |
Chemical Identifiers
| CAS Number | 17781-95-2 |
|---|---|
| SMILES | CCN(CC)CC#CCOC(=O)C1(CCCC1)C2=CC=CC=C2.Cl |
| InChIKey | ZWATXJNMDZYTBD-UHFFFAOYSA-N |
Product Overview
RefChem:335949 (CAS 17781-95-2), with molecular formula C20H28ClNO2 and molecular weight 349.18085 g/mol. IUPAC: 4-(diethylamino)but-2-ynyl 1-phenylcyclopentane-1-carboxylate;hydrochloride.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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