1-Azoniabicyclo[2.2.2]Oct-2-En-3-Ylmethyl 2-Cyclopentyl-2-Hydroxy-2-Phenylacetate Chloride
[CAS# 101710-75-2]

Identification

• Name: 1-Azoniabicyclo[2.2.2]Oct-2-En-3-Ylmethyl 2-Cyclopentyl-2-Hydroxy-2-Phenylacetate Chloride
• Synonyms: 1-Azoniabicyclo[2.2.2]Oct-2-En-3-Ylmethyl 2-Cyclopentyl-2-Hydroxy-2-Phenyl-Acetate Chloride; 2-Cyclopentyl-2-Hydroxy-2-Phenylacetic Acid 1-Azoniabicyclo[2.2.2]Oct-2-En-3-Ylmethyl Ester Chloride; 2-Cyclopentyl-2-Hydroxy-2-Phenyl-Acetic Acid 1-Azoniabicyclo[2.2.2]Oct-2-En-3-Ylmethyl Ester Chloride
• Molecular Formula: C₂₁H₂₈ClNO₃
• Molecular Weight: 377.91
• CAS Registry Number: 101710-75-2
• SMILES: C1=CC=CC=C1C(O)(C2CCCC2)C(OCC3=C[NH+]4CCC3CC4)=O.[Cl-]
• InChI: 1S/C21H27NO3.ClH/c23-20(25-15-17-14-22-12-10-16(17)11-13-22)21(24,19-8-4-5-9-19)18-6-2-1-3-7-18;/h1-3,6-7,14,16,19,24H,4-5,8-13,15H2;1H
• InChIKey: QYGXJQLHENVCKH-UHFFFAOYSA-N

Properties

• Boiling point: 512.7°C at 760 mmHg (Cal.)
• Flash point: 263.8°C (Cal.)