19-Nortestosterone Nitrosocarbamate
[CAS# 54025-36-4]

Identification

• Name: 19-Nortestosterone Nitrosocarbamate
• Synonyms: [(8R,9S,10R,13S,14S,17S)-13-Methyl-3-Oxo-2,6,7,8,9,10,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-17-Yl] N-(2-Chloroethyl)-N-Nitroso-Carbamate; N-(2-Chloroethyl)-N-Nitrosocarbamic Acid [(8R,9S,10R,13S,14S,17S)-13-Methyl-3-Oxo-2,6,7,8,9,10,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-17-Yl] Ester; N-(2-Chloroethyl)-N-Nitroso-Carbamic Acid [(8R,9S,10R,13S,14S,17S)-3-Keto-13-Methyl-2,6,7,8,9,10,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-17-Yl] Ester
• Molecular Formula: C₂₁H₂₉ClN₂O₄
• Molecular Weight: 408.92
• CAS Registry Number: 54025-36-4
• SMILES: [C@H]34[C@H]2[C@@H]([C@@H]1C(=CC(=O)CC1)CC2)CC[C@@]3([C@@H](OC(N(CCCl)N=O)=O)CC4)C
• InChI: 1S/C21H29ClN2O4/c1-21-9-8-16-15-5-3-14(25)12-13(15)2-4-17(16)18(21)6-7-19(21)28-20(26)24(23-27)11-10-22/h12,15-19H,2-11H2,1H3/t15-,16+,17+,18-,19-,21-/m0/s1
• InChIKey: KTQUNVRSLAGBSY-RRFJAZBJSA-N

Properties

• Density: 1.439g/cm³ (Cal.)
• Boiling point: 529.419°C at 760 mmHg (Cal.)
• Flash point: 273.983°C (Cal.)