17-(N,N,-Diisopropylcarbamoyl)Androst-3,5-Diene-3-Carboxylic Acid
[CAS# 119190-36-2]

Identification

• Name: 17-(N,N,-Diisopropylcarbamoyl)Androst-3,5-Diene-3-Carboxylic Acid
• Synonyms: (8S,9S,10R,13S,14S,17S)-17-(Diisopropylcarbamoyl)-10,13-Dimethyl-2,7,8,9,11,12,14,15,16,17-Decahydro-1H-Cyclopenta[A]Phenanthrene-3-Carboxylic Acid; (8S,9S,10R,13S,14S,17S)-17-[(Diisopropylamino)-Oxomethyl]-10,13-Dimethyl-2,7,8,9,11,12,14,15,16,17-Decahydro-1H-Cyclopenta[A]Phenanthrene-3-Carboxylic Acid; 17-(N,N,-Diisopropylcarbamoyl)Androst-3,5-Diene-3-Carboxylic Acid
• Molecular Formula: C₂₇H₄₁NO₃
• Molecular Weight: 427.63
• CAS Registry Number: 119190-36-2
• SMILES: [C@@H]23CC=C1C=C(CC[C@@]1([C@H]2CC[C@]4([C@H]3CC[C@@H]4C(=O)N(C(C)C)C(C)C)C)C)C(=O)O
• InChI: 1S/C27H41NO3/c1-16(2)28(17(3)4)24(29)23-10-9-21-20-8-7-19-15-18(25(30)31)11-13-26(19,5)22(20)12-14-27(21,23)6/h7,15-17,20-23H,8-14H2,1-6H3,(H,30,31)/t20-,21-,22-,23+,26-,27-/m0/s1
• InChIKey: JDAULUKGZUDSNK-JRZBRKEGSA-N

Properties

• Density: 1.114g/cm³ (Cal.)
• Boiling point: 580.584°C at 760 mmHg (Cal.)
• Flash point: 304.926°C (Cal.)