17beta-Hydroxy-5alpha-Estran-3-One O-(2,4-Dinitrophenyl)Oxime
[CAS# 64584-77-6]

Identification

• Name: 17beta-Hydroxy-5alpha-Estran-3-One O-(2,4-Dinitrophenyl)Oxime
• Synonyms: 17-Beta-Hydroxy-5-Alpha-Estran-3-One O-(2,4-Dinitrophenyl)Oxime; 5-Alpha-Estran-3-One, 17-Beta-Hydroxy-, O-(2,4-Dinitrophenyl)Oxime
• Molecular Formula: C₂₄H₃₁N₃O₆
• Molecular Weight: 457.53
• CAS Registry Number: 64584-77-6
• SMILES: [C@@H]5(O)C4(C(C1C(C3C(CC1)C\C(=N/OC2=CC=C([N+]([O-])=O)C=C2[N+]([O-])=O)CC3)CC4)CC5)C
• InChI: 1S/C24H31N3O6/c1-24-11-10-18-17-6-3-15(12-14(17)2-5-19(18)20(24)7-9-23(24)28)25-33-22-8-4-16(26(29)30)13-21(22)27(31)32/h4,8,13-14,17-20,23,28H,2-3,5-7,9-12H2,1H3/b25-15-/t14?,17?,18?,19?,20?,23-,24?/m0/s1
• InChIKey: CBVHQTSAURKXCY-ULGFPWCFSA-N

Properties

• Density: 1.527g/cm³ (Cal.)
• Boiling point: 606.068°C at 760 mmHg (Cal.)
• Flash point: 320.339°C (Cal.)