20-(Hydroxymethyl)-4-Methyl-4-Aza-2-Oxapregnan-3-One
[CAS# 96000-11-2]

Identification

• Name: 20-(Hydroxymethyl)-4-Methyl-4-Aza-2-Oxapregnan-3-One
• Synonyms: 20-Hmaop; 20-Hydroxymethyl-4-Methyl-4-Aza-2-Oxa-5Alpha-Pregnan-3-One
• Molecular Formula: C₂₁H₃₅NO₃
• Molecular Weight: 349.51
• CAS Registry Number: 96000-11-2
• SMILES: [C@@]12(COC(N([C@@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@@H]4[C@@H](CO)C)C)C)=O)C
• InChI: 1S/C21H35NO3/c1-13(11-23)15-6-7-16-14-5-8-18-21(3,12-25-19(24)22(18)4)17(14)9-10-20(15,16)2/h13-18,23H,5-12H2,1-4H3/t13-,14+,15-,16+,17+,18-,20-,21-/m1/s1
• InChIKey: VQISOTOPDCGBAH-GRYWWZJOSA-N

Properties

• Density: 1.084g/cm³ (Cal.)
• Boiling point: 502.479°C at 760 mmHg (Cal.)
• Flash point: 257.69°C (Cal.)