2,4,6-Trinitro-1,3,5-Benzenetriol
[CAS# 4328-17-0]

Identification

• Name: 2,4,6-Trinitro-1,3,5-Benzenetriol
• Synonyms: 2,4,6-Trinitrophloroglucinol; 1,3,5-Benzenetriol, 2,4,6-Trinitro-; Nsc99831
• Molecular Formula: C₆H₃N₃O₉
• Molecular Weight: 261.10
• CAS Registry Number: 4328-17-0
• SMILES: C1(=C(O)C(=C(O)C(=C1O)[N+]([O-])=O)[N+]([O-])=O)[N+]([O-])=O
• InChI: 1S/C6H3N3O9/c10-4-1(7(13)14)5(11)3(9(17)18)6(12)2(4)8(15)16/h10-12H
• InChIKey: WUCYBAXJJOWQFF-UHFFFAOYSA-N

Properties

• Density: 2.171g/cm³ (Cal.)
• Boiling point: 290.354°C at 760 mmHg (Cal.)
• Flash point: 124.255°C (Cal.)

References

• (1): J. J. Wolff, F. Gredel, H. Irngartinger and T. Dreier. Trinitrophloroglucinol, Acta Cryst. (1996). C52, 3225-3227