1,1,1-Trinitropropane
[CAS# 5437-63-8]

Identification

• Name: 1,1,1-Trinitropropane
• Synonyms: Brn 1841917; Nsc 16154; Nsc16154
• Molecular Formula: C₃H₅N₃O₆
• Molecular Weight: 179.09
• CAS Registry Number: 5437-63-8
• SMILES: C(C([N+]([O-])=O)([N+]([O-])=O)[N+]([O-])=O)C
• InChI: 1S/C3H5N3O6/c1-2-3(4(7)8,5(9)10)6(11)12/h2H2,1H3
• InChIKey: WFNMEOVAYOYUJO-UHFFFAOYSA-N

Properties

• Density: 1.538g/cm³ (Cal.)
• Boiling point: 202.217°C at 760 mmHg (Cal.)
• Flash point: 78.837°C (Cal.)