1,3,5(10)-Estratrien-3,15-alpha,17-beta-Triol
[CAS# 570-30-9]

Identification

• Name: 1,3,5(10)-Estratrien-3,15-alpha,17-beta-Triol
• Synonyms: 15Alpha-Hydroxyestradiol; Estra-1,3,5(10)-Triene-3,15Alpha,17-Triol
• Molecular Formula: C₁₈H₂₄O₃
• Molecular Weight: 288.39
• CAS Registry Number: 570-30-9
• SMILES: [C@@H]23CCC1=C(C=CC(=C1)O)[C@H]2CC[C@]4([C@H]3[C@H](C[C@@H]4O)O)C
• InChI: 1S/C18H24O3/c1-18-7-6-13-12-5-3-11(19)8-10(12)2-4-14(13)17(18)15(20)9-16(18)21/h3,5,8,13-17,19-21H,2,4,6-7,9H2,1H3/t13-,14-,15+,16+,17-,18-/m1/s1
• InChIKey: QVQMPLATUBCZMQ-GVLSGGHMSA-N

Properties

• Density: 1.256g/cm³ (Cal.)
• Boiling point: 493.107°C at 760 mmHg (Cal.)
• Flash point: 233.746°C (Cal.)