3-Methoxyestra-1,3,5(10)-Triene-4,17-Diol
[CAS# 5976-66-9]

Identification

• Name: 3-Methoxyestra-1,3,5(10)-Triene-4,17-Diol
• Synonyms: 3-Methoxyestra-1,3,5(10)-triene-4,17-diol; 3-Methoxyestra-1,3,5(10)-triene-4,17-diol #; 3-O-METHYL 4-HYDROXY ESTRADIOL
• Molecular Formula: C₁₉H₂₆O₃
• Molecular Weight: 302.41
• CAS Registry Number: 5976-66-9
• SMILES: O(c1ccc2c(c1O)CCC4C2CCC3(C4CCC3O)C)C
• InChI: 1S/C19H26O3/c1-19-10-9-12-11-5-7-16(22-2)18(21)14(11)4-3-13(12)15(19)6-8-17(19)20/h5,7,12-13,15,17,20-21H,3-4,6,8-10H2,1-2H3
• InChIKey: QREWTGIWXABZAC-UHFFFAOYSA-N

Properties

• Density: 1.178g/cm³ (Cal.)
• Boiling point: 452.709°C at 760 mmHg (Cal.)
• Flash point: 227.591°C (Cal.)