20,21-Dihydroxypregn-4-Ene-3,11-Dione
[CAS# 116-56-3]

Identification

• Name: 20,21-Dihydroxypregn-4-Ene-3,11-Dione
• Molecular Formula: C₂₁H₃₀O₄
• Molecular Weight: 346.46
• CAS Registry Number: 116-56-3
• SMILES: OCC(O)[C@H]3CC[C@H]2[C@@H]4CC/C1=C/C(=O)CC[C@]1(C)[C@H]4C(=O)C[C@@]23C
• InChI: 1S/C21H30O4/c1-20-8-7-13(23)9-12(20)3-4-14-15-5-6-16(18(25)11-22)21(15,2)10-17(24)19(14)20/h9,14-16,18-19,22,25H,3-8,10-11H2,1-2H3/t14-,15-,16+,18?,19+,20-,21-/m0/s1
• InChIKey: UJDLFLAJWMSLEB-RGCRHRMLSA-N

Properties

• Density: 1.219g/cm³ (Cal.)
• Boiling point: 550.251°C at 760 mmHg (Cal.)
• Flash point: 300.642°C (Cal.)
• Refractive index: 1.575 (Cal.)