1,8-Dihydroxy-2,4,5-Trinitroanthraquinone
[CAS# 67905-61-7]

Identification

• Name: 1,8-Dihydroxy-2,4,5-Trinitroanthraquinone
• Synonyms: 1,8-Dihydroxy-2,4,5-Trinitro-Anthracene-9,10-Dione; 1,8-Dihydroxy-2,4,5-Trinitro-9,10-Anthraquinone
• Molecular Formula: C₁₄H₅N₃O₁₀
• Molecular Weight: 375.21
• CAS Registry Number: 67905-61-7
• EINECS: 267-682-1
• SMILES: C1=CC(=C3C(=C1O)C(=O)C2=C(C(=CC(=C2O)[N+]([O-])=O)[N+]([O-])=O)C3=O)[N+]([O-])=O
• InChI: 1S/C14H5N3O10/c18-7-2-1-4(15(22)23)8-10(7)14(21)11-9(13(8)20)5(16(24)25)3-6(12(11)19)17(26)27/h1-3,18-19H
• InChIKey: ZBTXWMXJWUFKMS-UHFFFAOYSA-N

Properties

• Density: 1.96g/cm³ (Cal.)
• Boiling point: 684.495°C at 760 mmHg (Cal.)
• Flash point: 283.293°C (Cal.)