Androsta-3,5-Dien-17-beta-Amine Mandelate
[CAS# 19401-63-9]

Identification

• Name: Androsta-3,5-Dien-17-beta-Amine Mandelate
• Synonyms: (8R,9S,10R,13S,14S,17S)-10,13-Dimethyl-2,7,8,9,11,12,14,15,16,17-Decahydro-1H-Cyclopenta[A]Phenanthren-17-Amine; 2-Hydroxy-2-Phenyl-Acetic Acid; [(8R,9S,10R,13S,14S,17S)-10,13-Dimethyl-2,7,8,9,11,12,14,15,16,17-Decahydro-1H-Cyclopenta[A]Phenanthren-17-Yl]Amine; 2-Hydroxy-2-Phenyl-Acetic Acid; (8R,9S,10R,13S,14S,17S)-10,13-Dimethyl-2,7,8,9,11,12,14,15,16,17-Decahydro-1H-Cyclopenta[A]Phenanthren-17-Amine; 2-Hydroxy-2-Phenyl-Ethanoic Acid
• Molecular Formula: C₂₇H₃₇NO₃
• Molecular Weight: 423.59
• CAS Registry Number: 19401-63-9
• SMILES: [C@H]23[C@H]1[C@@]([C@@H](N)CC1)(CC[C@@H]2[C@@]4(C(=CC3)C=CCC4)C)C.C5=C(C(O)C(=O)O)C=CC=C5
• InChI: 1S/C19H29N.C8H8O3/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18;9-7(8(10)11)6-4-2-1-3-5-6/h3,5-6,14-17H,4,7-12,20H2,1-2H3;1-5,7,9H,(H,10,11)/t14-,15-,16-,17-,18-,19-;/m0./s1
• InChIKey: BZZMWNNQVCCGON-JZSNIJFVSA-N

Properties

• Boiling point: 387.8°C at 760 mmHg (Cal.)
• Flash point: 191.7°C (Cal.)