1alpha,2alpha-Epoxycholesta-4,6-Dien-3-One
[CAS# 28893-44-9]

Identification

• Name: 1alpha,2alpha-Epoxycholesta-4,6-Dien-3-One
• Molecular Formula: C₂₇H₄₀O₂
• Molecular Weight: 396.61
• CAS Registry Number: 28893-44-9
• EINECS: 249-291-8
• SMILES: C(CC(C5C4(C(C3C(C2(C1C(O1)C(C=C2C=C3)=O)C)CC4)CC5)C)C)CC(C)C
• InChI: 1S/C27H40O2/c1-16(2)7-6-8-17(3)20-11-12-21-19-10-9-18-15-23(28)24-25(29-24)27(18,5)22(19)13-14-26(20,21)4/h9-10,15-17,19-22,24-25H,6-8,11-14H2,1-5H3
• InChIKey: HOSZMOQCLZCHTD-UHFFFAOYSA-N

Properties

• Density: 1.066g/cm³ (Cal.)
• Boiling point: 514.036°C at 760 mmHg (Cal.)
• Flash point: 191.864°C (Cal.)