S-Deoxo-3,17|A-bis-(O-tetrahydro-2H-pyran-2-yl)-6-oxo-fulvestrant
[CAS# 862700-70-7]

Identification

• Name: S-Deoxo-3,17|A-bis-(O-tetrahydro-2H-pyran-2-yl)-6-oxo-fulvestrant
• Molecular Formula: C₄₂H₆₁F₅O₅S
• Molecular Weight: 772.99
• CAS Registry Number: 862700-70-7
• SMILES: C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2OC4CCCCO4)[C@@H](C(=O)C5=C3C=CC(=C5)OC6CCCCO6)CCCCCCCCCSCCCC(C(F)(F)F)(F)F

Properties

• Density: 1.2±0.1 g/cm³, Calc.^*
• Index of Refraction: 1.531, Calc.^*
• Boiling Point: 747.5±60.0 °C (760 mmHg), Calc.^*
• Flash Point: 405.9±32.9 °C, Calc.^*

^* Calculated using Advanced Chemistry Development (ACD/Labs) Software.