Chavicine
[CAS# 495-91-0]

Identification

• Name: Chavicine
• Synonyms: (2Z,4Z)-5-(1,3-Benzodioxol-5-Yl)-1-(1-Piperidyl)Penta-2,4-Dien-1-One; (2Z,4Z)-5-(1,3-Benzodioxol-5-Yl)-1-Piperidino-Penta-2,4-Dien-1-One; (2Z,4Z)-5-(1,3-Benzodioxol-5-Yl)-1-Piperidin-1-Yl-Penta-2,4-Dien-1-One
• Molecular Formula: C₁₇H₁₉NO₃
• Molecular Weight: 285.34
• CAS Registry Number: 495-91-0
• SMILES: C2=C1OCOC1=CC=C2\C=C/C=C\C(=O)N3CCCCC3
• InChI: 1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2-,7-3-
• InChIKey: MXXWOMGUGJBKIW-PORYWJCVSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 498.5±40.0°C at 760 mmHg (Cal.)
• Flash point: 255.3±27.3°C (Cal.)