(3E,17S)-13-Methyl-3-(4-Nitrophenoxy)Imino-2,6,7,8,9,10,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[a]Phenanthren-17-Ol
[CAS# 33510-67-7]

Identification

• Name: (3E,17S)-13-Methyl-3-(4-Nitrophenoxy)Imino-2,6,7,8,9,10,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[a]Phenanthren-17-Ol
• Synonyms: 17-Beta-Hydroxyestr-4-En-3-One O-(P-Nitrophenyl)Oxime; Brn 2189012; Estr-4-En-3-One, 17-Beta-Hydroxy-, O-(P-Nitrophenyl)Oxime
• Molecular Formula: C₂₄H₃₀N₂O₄
• Molecular Weight: 410.51
• CAS Registry Number: 33510-67-7
• SMILES: [C@@H]5(O)C4(C(C3C(C2C(=CC(=N/OC1=CC=C([N+]([O-])=O)C=C1)/CC2)CC3)CC4)CC5)C
• InChI: 1S/C24H30N2O4/c1-24-13-12-20-19-9-3-16(25-30-18-6-4-17(5-7-18)26(28)29)14-15(19)2-8-21(20)22(24)10-11-23(24)27/h4-7,14,19-23,27H,2-3,8-13H2,1H3/b25-16+/t19?,20?,21?,22?,23-,24?/m0/s1
• InChIKey: ULXKAIMYVOPRPG-HMPDCFESSA-N

Properties

• Density: 1.394g/cm³ (Cal.)
• Boiling point: 575.465°C at 760 mmHg (Cal.)
• Flash point: 301.83°C (Cal.)