2-Acetoxy-5-Iodo-3-Nitrobenzoic Acid
[CAS# 22884-73-7]

Identification

• Name: 2-Acetoxy-5-Iodo-3-Nitrobenzoic Acid
• Synonyms: 2-(Acetyloxy)-5-iodo-3-nitrobenzoic acid; 2-(Acetyloxy)-5-iodo-3-nitrobenzoic acid #; Salicylic acid, 5-iodo-3-nitro-, acetate (ester)
• Molecular Formula: C₉H₆INO₆
• Molecular Weight: 351.05
• CAS Registry Number: 22884-73-7
• SMILES: O=C(Oc1c(cc(I)cc1[N+]([O-])=O)C(=O)O)C
• InChI: 1S/C9H6INO6/c1-4(12)17-8-6(9(13)14)2-5(10)3-7(8)11(15)16/h2-3H,1H3,(H,13,14)
• InChIKey: BKKTXUWONZPPNK-UHFFFAOYSA-N

Properties

• Density: 2.023g/cm³ (Cal.)
• Boiling point: 452.646°C at 760 mmHg (Cal.)
• Flash point: 227.552°C (Cal.)
• Refractive index: 1.659 (Cal.)