1-(2-Deoxy-beta-D-Erythro-Pentofuranosyl)-3-Nitro-1H-Pyrrole
[CAS# 157066-48-3]

Identification

• Name: 1-(2-Deoxy-beta-D-Erythro-Pentofuranosyl)-3-Nitro-1H-Pyrrole
• Synonyms: (2R,3S,5S)-2-(Hydroxymethyl)-5-(3-Nitropyrrol-1-Yl)Tetrahydrofuran-3-Ol; (2R,3S,5S)-2-(Hydroxymethyl)-5-(3-Nitro-1-Pyrrolyl)-3-Tetrahydrofuranol; (2R,3S,5S)-2-Methylol-5-(3-Nitropyrrol-1-Yl)Tetrahydrofuran-3-Ol
• Molecular Formula: C₉H₁₂N₂O₅
• Molecular Weight: 228.20
• CAS Registry Number: 157066-48-3
• SMILES: [C@H]2([N]1C=C(C=C1)[N+](=O)[O-])O[C@@H]([C@@H](O)C2)CO
• InChI: 1S/C9H12N2O5/c12-5-8-7(13)3-9(16-8)10-2-1-6(4-10)11(14)15/h1-2,4,7-9,12-13H,3,5H2/t7-,8+,9-/m0/s1
• InChIKey: WETFHJRYOTYZFD-YIZRAAEISA-N

Properties

• Density: 1.657g/cm³ (Cal.)
• Boiling point: 488.639°C at 760 mmHg (Cal.)
• Flash point: 249.32°C (Cal.)