5-Nitro-4-(2,4,6-Trinitrophenyl)Benzene-1,3-Dicarboxylic Acid
[CAS# 153341-04-9]

Identification

• Name: 5-Nitro-4-(2,4,6-Trinitrophenyl)Benzene-1,3-Dicarboxylic Acid
• Synonyms: 5-Nitro-4-(2,4,6-Trinitrophenyl)Isophthalic Acid; 2,4,6,2'-Tetranitro-4',6'-Dicarboxybiphenyl
• Molecular Formula: C₁₄H₆N₄O₁₂
• Molecular Weight: 422.22
• CAS Registry Number: 153341-04-9
• SMILES: C1=C([N+]([O-])=O)C=C([N+]([O-])=O)C(=C1[N+]([O-])=O)C2=C([N+]([O-])=O)C=C(C(=O)O)C=C2C(=O)O
• InChI: 1S/C14H6N4O12/c19-13(20)5-1-7(14(21)22)11(8(2-5)16(25)26)12-9(17(27)28)3-6(15(23)24)4-10(12)18(29)30/h1-4H,(H,19,20)(H,21,22)
• InChIKey: UZMXCLUPZRUZJH-UHFFFAOYSA-N

Properties

• Density: 1.859g/cm³ (Cal.)
• Boiling point: 593.682°C at 760 mmHg (Cal.)
• Flash point: 241.325°C (Cal.)