15-Oxaestra-1,3,5(10)-Triene-3,17beta-Diol
[CAS# 49849-01-6]

Identification

• Name: 15-Oxaestra-1,3,5(10)-Triene-3,17beta-Diol
• Synonyms: (1R,3As,3Br,9Bs,11Ar)-11A-Methyl-2,3A,3B,4,5,9B,10,11-Octahydro-1H-Naphtho[5,6-G]Benzofuran-1,7-Diol; 15-Oxa-1,3,5(10)-Estratriene-3,17-Beta-Diol; 15-Oxaestra-1,3,5(10)-Triene-3,17-Diol, (17-Beta)-
• Molecular Formula: C₁₇H₂₂O₃
• Molecular Weight: 274.36
• CAS Registry Number: 49849-01-6
• SMILES: [C@@H]23C1=CC=C(C=C1CC[C@H]2[C@H]4[C@](CC3)([C@H](CO4)O)C)O
• InChI: 1S/C17H22O3/c1-17-7-6-13-12-5-3-11(18)8-10(12)2-4-14(13)16(17)20-9-15(17)19/h3,5,8,13-16,18-19H,2,4,6-7,9H2,1H3/t13-,14-,15+,16+,17-/m1/s1
• InChIKey: JHBGIEZIDJQZJI-UHDSXZAQSA-N

Properties

• Density: 1.227g/cm³ (Cal.)
• Boiling point: 467.049°C at 760 mmHg (Cal.)
• Flash point: 236.263°C (Cal.)