2,2,2-Trinitroethanol
[CAS# 918-54-7]

Identification

• Name: 2,2,2-Trinitroethanol
• Synonyms: 4-01-00-01389 (Beilstein Handbook Reference); Brn 1790157; Ethanol, 2,2,2-Trinitro-
• Molecular Formula: C₂H₃N₃O₇
• Molecular Weight: 181.06
• CAS Registry Number: 918-54-7
• SMILES: C(O)C([N+]([O-])=O)([N+]([O-])=O)[N+]([O-])=O
• InChI: 1S/C2H3N3O7/c6-1-2(3(7)8,4(9)10)5(11)12/h6H,1H2
• InChIKey: JGAGBYRIJUMEDB-UHFFFAOYSA-N

Properties

• Density: 1.858g/cm³ (Cal.)
• Boiling point: 237.792°C at 760 mmHg (Cal.)
• Flash point: 108.426°C (Cal.)

References

• (1): M. Göbel and T. M. Klapötke. 2,2,2-Trinitroethanol, Acta Cryst. (2007). C63, o562-o564