2,3-Estrone O-Quinone
[CAS# 40551-33-5]

Identification

• Name: 2,3-Estrone O-Quinone
• Synonyms: 2,3-Eq; 2,3-Estrogen O-Quinone; 2,3-Estrone O-Quinone
• Molecular Formula: C₁₈H₂₀O₃
• Molecular Weight: 284.35
• CAS Registry Number: 40551-33-5
• SMILES: [C@H]24[C@H]1[C@@](C(=O)CC1)(CC[C@@H]2C3=CC(=O)C(=O)C=C3CC4)C
• InChI: 1S/C18H20O3/c1-18-7-6-11-12(14(18)4-5-17(18)21)3-2-10-8-15(19)16(20)9-13(10)11/h8-9,11-12,14H,2-7H2,1H3/t11-,12+,14-,18-/m0/s1
• InChIKey: WFPLOQDPWXNOST-JPVZDGGYSA-N

Properties

• Density: 1.24g/cm³ (Cal.)
• Boiling point: 483.438°C at 760 mmHg (Cal.)
• Flash point: 210.738°C (Cal.)