4-Iodo-5,6-Dimethoxy-7-Nitro-3H-Isobenzofuran-1-One
[CAS# 839-55-4]

Identification

• Name: 4-Iodo-5,6-Dimethoxy-7-Nitro-3H-Isobenzofuran-1-One
• Synonyms: 4-Iodo-5,6-Dimethoxy-7-Nitro-3H-Isobenzofuran-1-One; Nsc72950
• Molecular Formula: C₁₀H₈INO₆
• Molecular Weight: 365.08
• CAS Registry Number: 839-55-4
• SMILES: COC2=C([N+]([O-])=O)C1=C(COC1=O)C(=C2OC)I
• InChI: 1S/C10H8INO6/c1-16-8-6(11)4-3-18-10(13)5(4)7(12(14)15)9(8)17-2/h3H2,1-2H3
• InChIKey: XZFSDTYNGYJTMU-UHFFFAOYSA-N

Properties

• Density: 1.942g/cm³ (Cal.)
• Boiling point: 560.26°C at 760 mmHg (Cal.)
• Flash point: 292.635°C (Cal.)