Iodoxamic Acid Sodium Salt
[CAS# 100568-85-2]

Identification

• Name: Iodoxamic Acid Sodium Salt
• Synonyms: Disodium 3-[3-[2-[2-[2-[3-[(3-Carboxylato-2,4,6-Triiodo-Phenyl)Amino]-3-Oxo-Propoxy]Ethoxy]Ethoxy]Ethoxy]Propanoylamino]-2,4,6-Triiodo-Benzoate; Disodium 3-[[3-[2-[2-[2-[3-[(3-Carboxylato-2,4,6-Triiodophenyl)Amino]-3-Oxopropoxy]Ethoxy]Ethoxy]Ethoxy]-1-Oxopropyl]Amino]-2,4,6-Triiodobenzoate; Disodium 3-[3-[2-[2-[2-[3-[(3-Carboxylato-2,4,6-Triiodo-Phenyl)Amino]-3-Keto-Propoxy]Ethoxy]Ethoxy]Ethoxy]Propanoylamino]-2,4,6-Triiodo-Benzoate
• Molecular Formula: C₂₆H₂₄I₆N₂Na₂O₁₀
• Molecular Weight: 1331.89
• CAS Registry Number: 100568-85-2
• SMILES: C1=C(I)C(=C(I)C(=C1I)C([O-])=O)NC(=O)CCOCCOCCOCCOCCC(=O)NC2=C(I)C=C(I)C(=C2I)C([O-])=O.[Na+].[Na+]
• InChI: 1S/C26H26I6N2O10.2Na/c27-13-11-15(29)23(21(31)19(13)25(37)38)33-17(35)1-3-41-5-7-43-9-10-44-8-6-42-4-2-18(36)34-24-16(30)12-14(28)20(22(24)32)26(39)40;;/h11-12H,1-10H2,(H,33,35)(H,34,36)(H,37,38)(H,39,40);;/q;2*+1/p-2
• InChIKey: HGRQOYAKTUQPTC-UHFFFAOYSA-L

Properties

• Boiling point: 977.7°C at 760 mmHg (Cal.)
• Flash point: 545.1°C (Cal.)