10,13-Dimethyl-17-Sulfanyl-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[a]Phenanthren-3-One
[CAS# 6959-86-0]

Identification

• Name: 10,13-Dimethyl-17-Sulfanyl-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[a]Phenanthren-3-One
• Synonyms: 17-Mercapto-10,13-Dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[A]Phenanthren-3-One; Nsc69535; Nciopen2_009944
• Molecular Formula: C₁₉H₂₈OS
• Molecular Weight: 304.49
• CAS Registry Number: 6959-86-0
• SMILES: CC34C2C(C1C(C(S)CC1)(CC2)C)CCC3=CC(=O)CC4
• InChI: 1S/C19H28OS/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h11,14-17,21H,3-10H2,1-2H3
• InChIKey: UTCIDVRYIUGDKT-UHFFFAOYSA-N

Properties

• Density: 1.112g/cm³ (Cal.)
• Boiling point: 433.072°C at 760 mmHg (Cal.)
• Flash point: 215.714°C (Cal.)