[(2E)-2-(1-Azoniabicyclo[2.2.2]Octan-3-Ylidene)Ethyl] 2-Cyclopentyl-2-Hydroxy-2-Phenylacetate Chloride
[CAS# 101710-89-8]

Identification

• Name: [(2E)-2-(1-Azoniabicyclo[2.2.2]Octan-3-Ylidene)Ethyl] 2-Cyclopentyl-2-Hydroxy-2-Phenylacetate Chloride
• Synonyms: [(2E)-2-Quinuclidin-1-Ium-3-Ylideneethyl] 2-Cyclopentyl-2-Hydroxy-2-Phenyl-Acetate Chloride; 2-Cyclopentyl-2-Hydroxy-2-Phenylacetic Acid [(2E)-2-(3-Quinuclidin-1-Iumylidene)Ethyl] Ester Chloride; 2-Cyclopentyl-2-Hydroxy-2-Phenyl-Acetic Acid [(2E)-2-Quinuclidin-1-Ium-3-Ylideneethyl] Ester Chloride
• Molecular Formula: C₂₂H₃₀ClNO₃
• Molecular Weight: 391.94
• CAS Registry Number: 101710-89-8
• SMILES: C4=C(C(O)(C1CCCC1)C(OC/C=C/3C2CC[NH+](CC2)C3)=O)C=CC=C4.[Cl-]
• InChI: 1S/C22H29NO3.ClH/c24-21(26-15-12-18-16-23-13-10-17(18)11-14-23)22(25,20-8-4-5-9-20)19-6-2-1-3-7-19;/h1-3,6-7,12,17,20,25H,4-5,8-11,13-16H2;1H/b18-12-
• InChIKey: VYRIXWGSYXASMV-UWRQUICRSA-N

Properties

• Boiling point: 509.5°C at 760 mmHg (Cal.)
• Flash point: 261.9°C (Cal.)