9,11-Epoxypregn-4-Ene-17,21-Diol-3,20-Dione 21-Acetate
[CAS# 4383-30-6]

Identification

• Name: 9,11-Epoxypregn-4-Ene-17,21-Diol-3,20-Dione 21-Acetate
• Synonyms: Pregn-4-En-17,21-Diol-9.11-Epoxy-3,20-Dione, 21-Acetate(Ester); Nsc24231
• Molecular Formula: C₂₃H₃₀O₆
• Molecular Weight: 402.49
• CAS Registry Number: 4383-30-6
• SMILES: C(OC(C)=O)C(C1(O)CCC3C1(CC5C4(C2(C(=CC(CC2)=O)CCC34)C)O5)C)=O
• InChI: 1S/C23H30O6/c1-13(24)28-12-18(26)22(27)9-7-16-17-5-4-14-10-15(25)6-8-20(14,2)23(17)19(29-23)11-21(16,22)3/h10,16-17,19,27H,4-9,11-12H2,1-3H3
• InChIKey: QEBOBFQKUHEXGB-UHFFFAOYSA-N

Properties

• Density: 1.303g/cm³ (Cal.)
• Boiling point: 569.217°C at 760 mmHg (Cal.)
• Flash point: 195.517°C (Cal.)