3beta-Hydroxypregna-1,4-Dien-20-One
[CAS# 20272-84-8]

Identification

• Name: 3beta-Hydroxypregna-1,4-Dien-20-One
• Synonyms: 3Beta-Hydroxypregna-1,4-Dien-20-One
• Molecular Formula: C₂₁H₃₀O₂
• Molecular Weight: 314.47
• CAS Registry Number: 20272-84-8
• EINECS: 243-665-4
• SMILES: CC34C(C2C(C1(C(=CC(O)C=C1)CC2)C)CC3)CCC4C(=O)C
• InChI: 1S/C21H30O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h8,10,12,15-19,23H,4-7,9,11H2,1-3H3
• InChIKey: SEQJJASTRQIGNI-UHFFFAOYSA-N

Properties

• Density: 1.11g/cm³ (Cal.)
• Boiling point: 451.462°C at 760 mmHg (Cal.)
• Flash point: 192.306°C (Cal.)