Estra-1,3,5(10)-Triene-3,17beta-Diol Diheptanoate
[CAS# 7732-97-0]

Identification

• Name: Estra-1,3,5(10)-Triene-3,17beta-Diol Diheptanoate
• Synonyms: Heptanoic Acid [13-Methyl-3-(1-Oxoheptoxy)-6,7,8,9,11,12,14,15,16,17-Decahydrocyclopenta[A]Phenanthren-17-Yl] Ester; Enanthic Acid (3-Enanthyloxy-13-Methyl-6,7,8,9,11,12,14,15,16,17-Decahydrocyclopenta[A]Phenanthren-17-Yl) Ester
• Molecular Formula: C₃₂H₄₈O₄
• Molecular Weight: 496.73
• CAS Registry Number: 7732-97-0
• EINECS: 231-792-8
• SMILES: C1=C(OC(=O)CCCCCC)C=CC3=C1CCC4C2CCC(OC(CCCCCC)=O)C2(CCC34)C
• InChI: 1S/C32H48O4/c1-4-6-8-10-12-30(33)35-24-15-17-25-23(22-24)14-16-27-26(25)20-21-32(3)28(27)18-19-29(32)36-31(34)13-11-9-7-5-2/h15,17,22,26-29H,4-14,16,18-21H2,1-3H3
• InChIKey: OVAHZPTYWMWNKO-UHFFFAOYSA-N

Properties

• Density: 1.069g/cm³ (Cal.)
• Boiling point: 579.622°C at 760 mmHg (Cal.)
• Flash point: 280.856°C (Cal.)