2,4,6-Triiodo-3-(methylcarbamoyl)-5-(propanoylamino)benzoic acid

2,4,6-triiodo-3-(methylcarbamoyl)-5-(propanoylamino)benzoic acid

CAS: 3523-00-0

Molecular Formula	`C12H11I3N2O4`
Molecular Weight	627.7853 g/mol
LogP	2.91
Topological Polar Surface Area	95.5 Å²
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	3
Rotatable Bonds	4
Exact Mass	627.7853
Heavy Atoms	21
Complexity	631.7

Chemical Identifiers

CAS Number	3523-00-0
SMILES	`CCC(=O)NC1=C(C(=C(C(=C1I)C(=O)O)I)C(=O)NC)I`

Product Overview

2,4,6-Triiodo-3-(methylcarbamoyl)-5-(propanoylamino)benzoic acid (CAS 3523-00-0), with molecular formula C12H11I3N2O4 and molecular weight 627.7853 g/mol. IUPAC: 2,4,6-triiodo-3-(methylcarbamoyl)-5-(propanoylamino)benzoic acid.

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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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