1-[2-(5-Chloro-2-Ethoxyphenyl)-3-Methylpentyl]Hexahydro-1H-Azepine
[CAS# 29122-62-1]

Identification

• Name: 1-[2-(5-Chloro-2-Ethoxyphenyl)-3-Methylpentyl]Hexahydro-1H-Azepine
• Synonyms: 1-[2-(5-Chloro-2-Ethoxy-Phenyl)-3-Methyl-Pentyl]Azepane; Brn 1653733; 1-(Beta-(Sec-Butyl)-5-Chloro-2-Ethoxyphenethyl)Hexahydroazepine
• Molecular Formula: C₂₀H₃₂ClNO
• Molecular Weight: 337.93
• CAS Registry Number: 29122-62-1
• SMILES: C2=C(C(C(CC)C)CN1CCCCCC1)C(=CC=C2Cl)OCC
• InChI: 1S/C20H32ClNO/c1-4-16(3)19(15-22-12-8-6-7-9-13-22)18-14-17(21)10-11-20(18)23-5-2/h10-11,14,16,19H,4-9,12-13,15H2,1-3H3
• InChIKey: ADHODZSRIRPKGX-UHFFFAOYSA-N

Properties

• Density: 1.014g/cm³ (Cal.)
• Boiling point: 421.163°C at 760 mmHg (Cal.)
• Flash point: 208.512°C (Cal.)