2-(1-Azoniacyclohept-1-Yl)Ethyl N-[2-(Pentoxymethyl)Phenyl]Carbamate Chloride
[CAS# 80171-84-2]

Identification

• Name: 2-(1-Azoniacyclohept-1-Yl)Ethyl N-[2-(Pentoxymethyl)Phenyl]Carbamate Chloride
• Synonyms: N-[2-(Pentoxymethyl)Phenyl]Carbamic Acid 2-(1-Azepan-1-Iumyl)Ethyl Ester Chloride; N-[2-(Amoxymethyl)Phenyl]Carbamic Acid 2-(Azepan-1-Ium-1-Yl)Ethyl Ester Chloride; Amk 255
• Molecular Formula: C₂₁H₃₅ClN₂O₃
• Molecular Weight: 398.97
• CAS Registry Number: 80171-84-2
• SMILES: C2=C(NC(OCC[NH+]1CCCCCC1)=O)C(=CC=C2)COCCCCC.[Cl-]
• InChI: 1S/C21H34N2O3.ClH/c1-2-3-10-16-25-18-19-11-6-7-12-20(19)22-21(24)26-17-15-23-13-8-4-5-9-14-23;/h6-7,11-12H,2-5,8-10,13-18H2,1H3,(H,22,24);1H
• InChIKey: IBPLZBNKKOMWSL-UHFFFAOYSA-N

Properties

• Boiling point: 448.4°C at 760 mmHg (Cal.)
• Flash point: 225°C (Cal.)