(17beta)-17-(1-oxopropoxy)-Androst-4-en-3-one mixt. with 17beta-((4-methyl-1-oxopentyl)oxy)androst-4-en-3-one
[CAS# 75026-40-3]

Identification

• Name: (17beta)-17-(1-oxopropoxy)-Androst-4-en-3-one mixt. with 17beta-((4-methyl-1-oxopentyl)oxy)androst-4-en-3-one
• Synonyms: 4-Methylpentanoic Acid [(8R,9S,10R,13S,14S,17S)-10,13-Dimethyl-3-Oxo-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[A]Phenanthren-17-Yl] Ester; Propanoic Acid [(8R,9S,10R,13S,14S,17S)-10,13-Dimethyl-3-Oxo-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[A]Phenanthren-17-Yl] Ester; 4-Methylvaleric Acid [(8R,9S,10R,13S,14S,17S)-3-Keto-10,13-Dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[A]Phenanthren-17-Yl] Ester; Propionic Acid [(8R,9S,10R,13S,14S,17S)-3-Keto-10,13-Dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[A]Phenanthren-17-Yl] Ester; Ambosex
• Molecular Formula: C₄₇H₇₀O₆
• Molecular Weight: 731.07
• CAS Registry Number: 75026-40-3
• SMILES: [C@H]24[C@H]1[C@@]([C@@H](OC(=O)CCC(C)C)CC1)(CC[C@@H]2[C@@]3(C(=CC(=O)CC3)CC4)C)C.[C@H]68[C@H]5[C@@]([C@@H](OC(=O)CC)CC5)(CC[C@@H]6[C@@]7(C(=CC(=O)CC7)CC8)C)C
• InChI: 1S/C25H38O3.C22H32O3/c1-16(2)5-10-23(27)28-22-9-8-20-19-7-6-17-15-18(26)11-13-24(17,3)21(19)12-14-25(20,22)4;1-4-20(24)25-19-8-7-17-16-6-5-14-13-15(23)9-11-21(14,2)18(16)10-12-22(17,19)3/h15-16,19-22H,5-14H2,1-4H3;13,16-19H,4-12H2,1-3H3/t19-,20-,21-,22-,24-,25-;16-,17-,18-,19-,21-,22-/m00/s1
• InChIKey: ONMPQVOXSSXUIO-TXCQTBPESA-N

Properties

• Boiling point: 487.6°C at 760 mmHg (Cal.)
• Flash point: 208°C (Cal.)