7-(4'-Amino)Phenylthioandrostenedione
[CAS# 67340-72-1]

Identification

• Name: 7-(4'-Amino)Phenylthioandrostenedione
• Synonyms: (7R,8R,9S,10R,13S,14S)-7-[(4-Aminophenyl)Thio]-10,13-Dimethyl-2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthrene-3,17-Dione; (7R,8R,9S,10R,13S,14S)-7-[(4-Aminophenyl)Thio]-10,13-Dimethyl-2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthrene-3,17-Quinone; 7-(4'-Amino)Phenylthioandrostenedione
• Molecular Formula: C₂₅H₃₁NO₂S
• Molecular Weight: 409.59
• CAS Registry Number: 67340-72-1
• SMILES: [C@H]24[C@@H]([C@@]1(C(=CC(=O)CC1)C[C@H]2SC3=CC=C(N)C=C3)C)CC[C@]5([C@H]4CCC5=O)C
• InChI: 1S/C25H31NO2S/c1-24-11-9-17(27)13-15(24)14-21(29-18-5-3-16(26)4-6-18)23-19-7-8-22(28)25(19,2)12-10-20(23)24/h3-6,13,19-21,23H,7-12,14,26H2,1-2H3/t19-,20-,21+,23-,24-,25-/m0/s1
• InChIKey: OFMCSMLOQKMMIX-RGJWXQDMSA-N

Properties

• Density: 1.232g/cm³ (Cal.)
• Boiling point: 610.283°C at 760 mmHg (Cal.)
• Flash point: 322.888°C (Cal.)