3-((Hexyloxy)Methyl)-Carbanilic Acid 2-(1-Pyrrolidinyl)Ethyl Ester, Hydrochloride
[CAS# 80171-66-0]

Identification

• Name: 3-((Hexyloxy)Methyl)-Carbanilic Acid 2-(1-Pyrrolidinyl)Ethyl Ester, Hydrochloride
• Synonyms: N-[3-(Hexoxymethyl)Phenyl]Carbamic Acid 2-(1-Pyrrolidin-1-Iumyl)Ethyl Ester Chloride; N-[3-(Hexoxymethyl)Phenyl]Carbamic Acid 2-Pyrrolidin-1-Ium-1-Ylethyl Ester Chloride; 2-(1-Pyrrolidinyl)Ethyl M-((Hexyloxy)Methyl)Carbanilate Hydrochloride
• Molecular Formula: C₂₀H₃₃ClN₂O₃
• Molecular Weight: 384.95
• CAS Registry Number: 80171-66-0
• SMILES: C1=C(C=CC=C1NC(OCC[NH+]2CCCC2)=O)COCCCCCC.[Cl-]
• InChI: 1S/C20H32N2O3.ClH/c1-2-3-4-7-14-24-17-18-9-8-10-19(16-18)21-20(23)25-15-13-22-11-5-6-12-22;/h8-10,16H,2-7,11-15,17H2,1H3,(H,21,23);1H
• InChIKey: YOBNCRQOCSFWLF-UHFFFAOYSA-N

Properties

• Boiling point: 432.1°C at 760 mmHg (Cal.)
• Flash point: 215.1°C (Cal.)