1-Phenylcyclohexane-1-carboxylic acid quinuclidin-3-yl ester hydrochloride
[CAS# 49665-76-1]

Identification

• Name: 1-Phenylcyclohexane-1-carboxylic acid quinuclidin-3-yl ester hydrochloride
• Synonyms: Quinuclidin-3-Yl 1-Phenylcyclohexane-1-Carboxylate Hydrochloride; 1-Phenyl-1-Cyclohexanecarboxylic Acid 3-Quinuclidinyl Ester Hydrochloride; 1-Phenylcyclohexane-1-Carboxylic Acid Quinuclidin-3-Yl Ester Hydrochloride
• Molecular Formula: C₂₀H₂₈ClNO₂
• Molecular Weight: 349.90
• CAS Registry Number: 49665-76-1
• SMILES: [H+].C4=C(C3(C(OC1C2CCN(C1)CC2)=O)CCCCC3)C=CC=C4.[Cl-]
• InChI: 1S/C20H27NO2.ClH/c22-19(23-18-15-21-13-9-16(18)10-14-21)20(11-5-2-6-12-20)17-7-3-1-4-8-17;/h1,3-4,7-8,16,18H,2,5-6,9-15H2;1H
• InChIKey: JYIJKBFWCCAWNN-UHFFFAOYSA-N

Properties

• Boiling point: 424.3°C at 760 mmHg (Cal.)
• Flash point: 137.8°C (Cal.)