16beta-Estradiol
[CAS# 1225-58-7]

Identification

• Name: 16beta-Estradiol
• Synonyms: 16Beta-Estradiol; C15261; Estra-1,3,5(10)-Triene-3,16Beta-Diol
• Molecular Formula: C₁₈H₂₄O₂
• Molecular Weight: 272.39
• CAS Registry Number: 1225-58-7
• SMILES: [C@]13(C[C@H](C[C@H]1[C@@H]2CCC4=C([C@H]2CC3)C=CC(=C4)O)O)C
• InChI: 1S/C18H24O2/c1-18-7-6-15-14-5-3-12(19)8-11(14)2-4-16(15)17(18)9-13(20)10-18/h3,5,8,13,15-17,19-20H,2,4,6-7,9-10H2,1H3/t13-,15+,16+,17-,18+/m0/s1
• InChIKey: DVMAUGGKVWJBDV-IREHDKGXSA-N

Properties

• Density: 1.171g/cm³ (Cal.)
• Boiling point: 445.917°C at 760 mmHg (Cal.)
• Flash point: 209.634°C (Cal.)