Iopodic acid

3-[3-(dimethylaminomethylideneamino)-2,4,6-triiodophenyl]propanoic acid

CAS: 5587-89-3

Molecular Formula	`C12H13I3N2O2`
Molecular Weight	597.96 g/mol
LogP	3.3
Topological Polar Surface Area	52.9 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	5
Exact Mass	597.8111
Heavy Atoms	19
Complexity	339.0

Chemical Identifiers

CAS Number	5587-89-3
SMILES	`CN(C)C=NC1=C(C=C(C(=C1I)CCC(=O)O)I)I`
InChIKey	`YQNFBOJPTAXAKV-UHFFFAOYSA-N`

📖 Product Overview

Iopodic acid (CAS: 5587-89-3) is a chemical compound with molecular formula C12H13I3N2O2 and molecular weight 597.96 g/mol. Its IUPAC systematic name is 3-[3-(dimethylaminomethylideneamino)-2,4,6-triiodophenyl]propanoic acid. LogP 3.3 Topological Polar Surface Area 52.9 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 5 Exact Mass 597.8111 Heavy Atoms 19 Complexity 339.0 InChI Key: YQNFBOJPTAXAKV-UHFFFAOYSA-N. SMILES: CN(C)C=NC1=C(C=C(C(=C1I)CCC(=O)O)I)I.

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