Callicarpone
[CAS# 5938-11-4]

Identification

• Name: Callicarpone
• Synonyms: Callicarpone
• Molecular Formula: C₂₀H₂₈O₄
• Molecular Weight: 332.44
• CAS Registry Number: 5938-11-4
• SMILES: [C@]12([C@H](C(CCC1)(C)C)CC(=O)C4=C2C(=O)[C@H]3O[C@]3(C4)C(O)(C)C)C
• InChI: 1S/C20H28O4/c1-17(2)7-6-8-19(5)13(17)9-12(21)11-10-20(18(3,4)23)16(24-20)15(22)14(11)19/h13,16,23H,6-10H2,1-5H3/t13-,16+,19-,20-/m0/s1
• InChIKey: USEISAATSWUIGG-MVHCQYFOSA-N

Properties

• Density: 1.206g/cm³ (Cal.)
• Boiling point: 463.074°C at 760 mmHg (Cal.)
• Flash point: 160.125°C (Cal.)