3-Methylandrost-5-en-17-one
[CAS# 90468-14-7]

Identification

• Name: 3-Methylandrost-5-en-17-one
• Synonyms: Androst-5-En-17-One, 3-Methyl-, (3Beta)-; Ccris 3622; 3-Methylandrost-5-En-17-One
• Molecular Formula: C₂₀H₃₀O
• Molecular Weight: 286.46
• CAS Registry Number: 90468-14-7
• SMILES: [C@@H]4(CC[C@]2(C(=CC[C@H]3[C@@H]1CCC([C@@]1(C)CC[C@H]23)=O)C4)C)C
• InChI: 1S/C20H30O/c1-13-8-10-19(2)14(12-13)4-5-15-16-6-7-18(21)20(16,3)11-9-17(15)19/h4,13,15-17H,5-12H2,1-3H3/t13-,15-,16-,17-,19-,20-/m0/s1
• InChIKey: PDSLFUNQCAQCJE-SWEGMTMGSA-N

Properties

• Density: 1.039g/cm³ (Cal.)
• Boiling point: 391.396°C at 760 mmHg (Cal.)
• Flash point: 166.63°C (Cal.)