16alpha-Chloroestra-1,3,5(10)-Trien-17-One
[CAS# 20377-68-8]

Identification

• Name: 16alpha-Chloroestra-1,3,5(10)-Trien-17-One
• Synonyms: (16-Alpha)-16-Chloroestra-1,3,5(10)-Trien-1-One; 16-Alpha-Chloroestra-1,3,5(10)-Trien-17-One; Estra-1,3,5(10)-Trien-17-One, 16-Alpha-Chloro-
• Molecular Formula: C₁₈H₂₁ClO
• Molecular Weight: 288.82
• CAS Registry Number: 20377-68-8
• SMILES: C1=CC=CC4=C1C2C(C3C(CC2)(C(C(C3)Cl)=O)C)CC4
• InChI: 1S/C18H21ClO/c1-18-9-8-13-12-5-3-2-4-11(12)6-7-14(13)15(18)10-16(19)17(18)20/h2-5,13-16H,6-10H2,1H3
• InChIKey: CQCDLLULWREDCF-UHFFFAOYSA-N

Properties

• Density: 1.197g/cm³ (Cal.)
• Boiling point: 426.868°C at 760 mmHg (Cal.)
• Flash point: 252.035°C (Cal.)