Iodoxamate sodium

disodium;3-[3-[2-[2-[2-[3-(3-carboxylato-2,4,6-triiodoanilino)-3-oxopropoxy]ethoxy]ethoxy]ethoxy]propanoylamino]-2,4,6-triiodobenzoate

CAS: 100568-85-2

Molecular Formula	`C26H24I6N2Na2O10`
Molecular Weight	1331.9 g/mol
Topological Polar Surface Area	175.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	10
Rotatable Bonds	17
Exact Mass	1331.5496
Heavy Atoms	46
Complexity	857.0

Chemical Identifiers

CAS Number	100568-85-2
SMILES	`C1=C(C(=C(C(=C1I)NC(=O)CCOCCOCCOCCOCCC(=O)NC2=C(C=C(C(=C2I)C(=O)[O-])I)I)I)C(=O)[O-])I.[Na+].[Na+]`
InChIKey	`HGRQOYAKTUQPTC-UHFFFAOYSA-L`

📖 Product Overview

Iodoxamate sodium (CAS: 100568-85-2) is a chemical compound with molecular formula C26H24I6N2Na2O10 and molecular weight 1331.9 g/mol. Its IUPAC systematic name is disodium;3-[3-[2-[2-[2-[3-(3-carboxylato-2,4,6-triiodoanilino)-3-oxopropoxy]ethoxy]ethoxy]ethoxy]propanoylamino]-2,4,6-triiodobenzoate. Topological Polar Surface Area 175.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 10 Rotatable Bonds 17 Exact Mass 1331.5496 Heavy Atoms 46 Complexity 857.0 InChI Key: HGRQOYAKTUQPTC-UHFFFAOYSA-L. SMILES: C1=C(C(=C(C(=C1I)NC(=O)CCOCCOCCOCCOCCC(=O)NC2=C(C=C(C(=C2I)C(=O)[O-])I)I)I)C(=O)[O-])I.[Na+].[Na+].

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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