[(2R,3R,4R,5R)-1,2,4,5,6-Pentanitrooxyhexan-3-Yl] Nitrate
[CAS# 130-39-2]

Identification

• Name: [(2R,3R,4R,5R)-1,2,4,5,6-Pentanitrooxyhexan-3-Yl] Nitrate
• Synonyms: [(1R,2R,3R)-1-[(1R)-1,2-Dinitrooxyethyl]-2,3,4-Trinitrooxy-Butyl] Nitrate; Nitric Acid [(1R,2R,3R)-1-[(1R)-1,2-Dinitrooxyethyl]-2,3,4-Trinitrooxybutyl] Ester; Nitric Acid [(1R,2R,3R)-1-[(1R)-1,2-Dinitrooxyethyl]-2,3,4-Trinitrooxy-Butyl] Ester
• Molecular Formula: C₆H₈N₆O₁₈
• Molecular Weight: 452.16
• CAS Registry Number: 130-39-2
• SMILES: [C@H]([C@@H]([C@@H](CO[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-])([C@@H](CO[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-]
• InChI: 1S/C6H8N6O18/c13-7(14)25-1-3(27-9(17)18)5(29-11(21)22)6(30-12(23)24)4(28-10(19)20)2-26-8(15)16/h3-6H,1-2H2/t3-,4-,5-,6-/m1/s1
• InChIKey: DGMJZELBSFOPHH-KVTDHHQDSA-N

Properties

• Density: 1.854g/cm³ (Cal.)
• Boiling point: 537.12°C at 760 mmHg (Cal.)
• Flash point: 232.358°C (Cal.)