Benzoic acid, 4-(((2-hydroxypropyl)amino)carbonyl)-2,3,5,6-tetraiodo- structure

Benzoic acid, 4-(((2-hydroxypropyl)amino)carbonyl)-2,3,5,6-tetraiodo-

4-(2-hydroxypropylcarbamoyl)-2,3,5,6-tetraiodobenzoic acid

Also Known As: Tetrajodterephthalsaure-mono-beta-hydroxypropylamid|Terephthalamic acid, N-(2-hydroxypropyl)-2,3,5,6-tetraiodo-|Tetrajodterephthalsaure-mono-beta-hydroxypropylamid [German]|4-(((2-Hydroxypropyl)amino)carbonyl)-2,3,5,6-tetraiodobenzoic acid|4-[(2-hydroxypropyl)carbamoyl]-2,3,5,6-tetraiodobenzoic acid|Benzoic acid, 4-(((2-hydroxypropyl)amino)carbonyl)-2,3,5,6-tetraiodo-|4-(2-hydroxypropylcarbamoyl)-2,3,5,6-tetraiodobenzoic acid|CARBONIC ACID 2-METHYLPROPYL PYRIDIN-2-YL ESTER|4-{Hydroxy[(2-hydroxypropyl)imino]methyl}-2,3,5,6-tetraiodobenzoic acid

CAS: 394-31-0
Molecular Formula C11H9I4NO4
Molecular Weight 726.671 g/mol
LogP 3.1
Topological Polar Surface Area 86.6 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 4
Rotatable Bonds 4
Exact Mass 726.671
Monoisotopic Mass 726.671
Heavy Atoms 20
Complexity 367.0

Chemical Identifiers

CAS Number 394-31-0
SMILES CC(CNC(=O)C1=C(C(=C(C(=C1I)I)C(=O)O)I)I)O
InChIKey WFTBBDFAICPSMP-UHFFFAOYSA-N

Product Overview

Benzoic acid, 4-(((2-hydroxypropyl)amino)carbonyl)-2,3,5,6-tetraiodo- (CAS 394-31-0), with molecular formula C11H9I4NO4 and molecular weight 726.671 g/mol. IUPAC: 4-(2-hydroxypropylcarbamoyl)-2,3,5,6-tetraiodobenzoic acid.

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