Homoestradiol
[CAS# 22059-16-1]

Identification

• Name: Homoestradiol
• Synonyms: D-Homoestra-1,3,5(10)-Triene-3,17-Diol; D-Homoestra-1,3,5(10)-Triene-3,17A-Diol, (17Aalpha)-; Homo-Estradiol
• Molecular Formula: C₁₉H₂₆O₂
• Molecular Weight: 286.41
• CAS Registry Number: 22059-16-1
• SMILES: [C@H]4(O)[C@@]1([C@H]([C@H]3[C@H](CC1)C2=CC=C(C=C2CC3)O)CCC4)C
• InChI: 1S/C19H26O2/c1-19-10-9-15-14-8-6-13(20)11-12(14)5-7-16(15)17(19)3-2-4-18(19)21/h6,8,11,15-18,20-21H,2-5,7,9-10H2,1H3/t15-,16-,17+,18-,19+/m1/s1
• InChIKey: JJKPSTJJBVJKKQ-FQBWVUSXSA-N

Properties

• Density: 1.144g/cm³ (Cal.)
• Boiling point: 458.863°C at 760 mmHg (Cal.)
• Flash point: 213.365°C (Cal.)