(2R,4S)-N-[(2R)-1,3-Dihydroxy-1-(4-Nitrophenyl)Propan-2-Yl]-1-Methyl-4-Propylpyrrolidine-2-Carboxamide
[CAS# 148077-13-8]

Identification

• Name: (2R,4S)-N-[(2R)-1,3-Dihydroxy-1-(4-Nitrophenyl)Propan-2-Yl]-1-Methyl-4-Propylpyrrolidine-2-Carboxamide
• Synonyms: (2R,4S)-N-[(1R)-2-Hydroxy-1-(Hydroxymethyl)-2-(4-Nitrophenyl)Ethyl]-1-Methyl-4-Propyl-Pyrrolidine-2-Carboxamide; (2R,4S)-N-[(1R)-2-Hydroxy-1-(Hydroxymethyl)-2-(4-Nitrophenyl)Ethyl]-1-Methyl-4-Propyl-2-Pyrrolidinecarboxamide; (2R,4S)-N-[(1R)-2-Hydroxy-1-Methylol-2-(4-Nitrophenyl)Ethyl]-1-Methyl-4-Propyl-Pyrrolidine-2-Carboxamide
• Molecular Formula: C₁₈H₂₇N₃O₅
• Molecular Weight: 365.43
• CAS Registry Number: 148077-13-8
• SMILES: [C@H]1(N(C[C@H](C1)CCC)C)C(=O)N[C@@H](C(O)C2=CC=C([N+]([O-])=O)C=C2)CO
• InChI: 1S/C18H27N3O5/c1-3-4-12-9-16(20(2)10-12)18(24)19-15(11-22)17(23)13-5-7-14(8-6-13)21(25)26/h5-8,12,15-17,22-23H,3-4,9-11H2,1-2H3,(H,19,24)/t12-,15+,16+,17?/m0/s1
• InChIKey: SEQRYZQRTVCQIV-CABRCNIHSA-N

Properties

• Density: 1.236g/cm³ (Cal.)
• Boiling point: 616.457°C at 760 mmHg (Cal.)
• Flash point: 326.622°C (Cal.)