3-Hydroxyestra-1,3,5(10),7-Tetraen-17-One 3-Acetate
[CAS# 43085-97-8]

Identification

• Name: 3-Hydroxyestra-1,3,5(10),7-Tetraen-17-One 3-Acetate
• Synonyms: Acetic Acid [(9S,13S,14S)-13-Methyl-17-Oxo-9,11,12,14,15,16-Hexahydro-6H-Cyclopenta[A]Phenanthren-3-Yl] Ester; Acetic Acid [(9S,13S,14S)-17-Keto-13-Methyl-9,11,12,14,15,16-Hexahydro-6H-Cyclopenta[A]Phenanthren-3-Yl] Ester; [(9S,13S,14S)-13-Methyl-17-Oxo-9,11,12,14,15,16-Hexahydro-6H-Cyclopenta[A]Phenanthren-3-Yl] Ethanoate
• Molecular Formula: C₂₀H₂₂O₃
• Molecular Weight: 310.39
• CAS Registry Number: 43085-97-8
• EINECS: 256-082-5
• SMILES: [C@H]14C(=CCC2=C1C=CC(=C2)OC(C)=O)[C@H]3[C@](C(=O)CC3)(C)CC4
• InChIKey: DBXQAPGFWYIOGN-KPFFTGBYSA-N

Properties

• Density: 1.208g/cm³ (Cal.)
• Boiling point: 465.644°C at 760 mmHg (Cal.)
• Flash point: 205.23°C (Cal.)