Iodoxamic acid

3-[3-[2-[2-[2-[3-(3-carboxy-2,4,6-triiodoanilino)-3-oxopropoxy]ethoxy]ethoxy]ethoxy]propanoylamino]-2,4,6-triiodobenzoic acid

CAS: 31127-82-9

Molecular Formula	`C26H26I6N2O10`
Molecular Weight	1287.9 g/mol
LogP	4.2
Topological Polar Surface Area	170.0 A2
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	10
Rotatable Bonds	19
Exact Mass	1287.5856
Heavy Atoms	44
Complexity	868.0

Chemical Identifiers

CAS Number	31127-82-9
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`
InChIKey	`WWVAPFRKZMUPHZ-UHFFFAOYSA-N`

📖 Product Overview

Iodoxamic acid (CAS: 31127-82-9) is a chemical compound with molecular formula C26H26I6N2O10 and molecular weight 1287.9 g/mol. Its IUPAC systematic name is 3-[3-[2-[2-[2-[3-(3-carboxy-2,4,6-triiodoanilino)-3-oxopropoxy]ethoxy]ethoxy]ethoxy]propanoylamino]-2,4,6-triiodobenzoic acid. LogP 4.2 Topological Polar Surface Area 170.0 A2 Hydrogen Bond Donors 4 Hydrogen Bond Acceptors 10 Rotatable Bonds 19 Exact Mass 1287.5856 Heavy Atoms 44 Complexity 868.0 InChI Key: WWVAPFRKZMUPHZ-UHFFFAOYSA-N. 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.

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