3-(Azepan-1-Yl)-1-(3-Ethyl-4-Propoxyphenyl)Propan-1-One Hydrochloride
[CAS# 30075-13-9]

Identification

• Name: 3-(Azepan-1-Yl)-1-(3-Ethyl-4-Propoxyphenyl)Propan-1-One Hydrochloride
• Synonyms: 3-(Azepan-1-Yl)-1-(3-Ethyl-4-Propoxy-Phenyl)Propan-1-One Hydrochloride; 3-(1-Azepanyl)-1-(3-Ethyl-4-Propoxyphenyl)Propan-1-One Hydrochloride; 1-Propanone, 1-(3-Ethyl-4-Propoxyphenyl)-3-(Hexahydro-1H-Azepin-1-Yl)-, Hydrochloride (9Ci)
• Molecular Formula: C₂₀H₃₂ClNO₂
• Molecular Weight: 353.93
• CAS Registry Number: 30075-13-9
• SMILES: [H+].C1=C(C(=CC=C1C(=O)CCN2CCCCCC2)OCCC)CC.[Cl-]
• InChI: 1S/C20H31NO2.ClH/c1-3-15-23-20-10-9-18(16-17(20)4-2)19(22)11-14-21-12-7-5-6-8-13-21;/h9-10,16H,3-8,11-15H2,1-2H3;1H
• InChIKey: DQICVBQNRQCIFB-UHFFFAOYSA-N

Properties

• Boiling point: 453.4°C at 760 mmHg (Cal.)
• Flash point: 228°C (Cal.)