5beta, 6beta-Epoxy-3beta-Hydroxypregnan-20-One
[CAS# 6585-70-2]

Identification

• Name: 5beta, 6beta-Epoxy-3beta-Hydroxypregnan-20-One
• Synonyms: 5Beta,6Beta-Epoxy-3Beta-Hydroxypregnan-20-One; Pregnenolone 5,6Beta-Epoxide
• Molecular Formula: C₂₁H₃₂O₃
• Molecular Weight: 332.48
• CAS Registry Number: 6585-70-2
• EINECS: 229-515-0
• SMILES: [C@@]123O[C@@H]1C[C@@H]4[C@@H]([C@]2(CC[C@@H](C3)O)C)CC[C@]5([C@H]4CC[C@@H]5C(=O)C)C
• InChI: 1S/C21H32O3/c1-12(22)15-4-5-16-14-10-18-21(24-18)11-13(23)6-9-20(21,3)17(14)7-8-19(15,16)2/h13-18,23H,4-11H2,1-3H3/t13-,14-,15+,16-,17-,18+,19+,20+,21+/m0/s1
• InChIKey: QLULPRPVLIPVFS-HUPPADNKSA-N

Properties

• Density: 1.166g/cm³ (Cal.)
• Boiling point: 465.238°C at 760 mmHg (Cal.)
• Flash point: 159.704°C (Cal.)