Methyl 2-(2-Methoxycarbonyl-4,6-Dinitrophenyl)-3,5-Dinitrobenzoate
[CAS# 74590-04-8]

Identification

• Name: Methyl 2-(2-Methoxycarbonyl-4,6-Dinitrophenyl)-3,5-Dinitrobenzoate
• Synonyms: Methyl 2-(2-Methoxycarbonyl-4,6-Dinitro-Phenyl)-3,5-Dinitro-Benzoate; 2-(2-Methoxycarbonyl-4,6-Dinitrophenyl)-3,5-Dinitrobenzoic Acid Methyl Ester; 2-(2-Carbomethoxy-4,6-Dinitro-Phenyl)-3,5-Dinitro-Benzoic Acid Methyl Ester
• Molecular Formula: C₁₆H₁₀N₄O₁₂
• Molecular Weight: 450.27
• CAS Registry Number: 74590-04-8
• SMILES: C1=C(C(=C([N+]([O-])=O)C=C1[N+]([O-])=O)C2=C([N+]([O-])=O)C=C([N+]([O-])=O)C=C2C(OC)=O)C(OC)=O
• InChI: 1S/C16H10N4O12/c1-31-15(21)9-3-7(17(23)24)5-11(19(27)28)13(9)14-10(16(22)32-2)4-8(18(25)26)6-12(14)20(29)30/h3-6H,1-2H3
• InChIKey: DAKJWQDVVRIVKB-UHFFFAOYSA-N

Properties

• Density: 1.62g/cm³ (Cal.)
• Boiling point: 627.028°C at 760 mmHg (Cal.)
• Flash point: 264.584°C (Cal.)