1-(4-Butoxyphenyl)-3-(Hexahydro-1H-Azepin-1-Yl)-1-Propanone
[CAS# 16870-63-6]

Identification

• Name: 1-(4-Butoxyphenyl)-3-(Hexahydro-1H-Azepin-1-Yl)-1-Propanone
• Synonyms: 3-(1-Azepanyl)-1-(4-Butoxyphenyl)Propan-1-One; Brn 1318547; N-Hexamethyleneimino-P-Butoxypropiophenone
• Molecular Formula: C₁₉H₂₉NO₂
• Molecular Weight: 303.44
• CAS Registry Number: 16870-63-6
• SMILES: C1=CC(=CC=C1OCCCC)C(=O)CCN2CCCCCC2
• InChI: 1S/C19H29NO2/c1-2-3-16-22-18-10-8-17(9-11-18)19(21)12-15-20-13-6-4-5-7-14-20/h8-11H,2-7,12-16H2,1H3
• InChIKey: FEMKAXDOHJXFEF-UHFFFAOYSA-N

Properties

• Density: 1.004g/cm³ (Cal.)
• Boiling point: 439.083°C at 760 mmHg (Cal.)
• Flash point: 219.35°C (Cal.)