BENZOIC ACID, 3-BUTYRAMIDO-2,4,6-TRIIODO-

3-(butanoylamino)-2,4,6-triiodobenzoic acid

CAS: 7181-71-7

Molecular Formula	`C11H10I3NO3`
Molecular Weight	584.91 g/mol
LogP	3.4
Topological Polar Surface Area	66.4 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	3
Rotatable Bonds	4
Exact Mass	584.7795
Heavy Atoms	18
Complexity	327.0

Chemical Identifiers

CAS Number	7181-71-7
SMILES	`CCCC(=O)NC1=C(C=C(C(=C1I)C(=O)O)I)I`
InChIKey	`QEKXGWMRPSGUEC-UHFFFAOYSA-N`

📖 Product Overview

BENZOIC ACID, 3-BUTYRAMIDO-2,4,6-TRIIODO- (CAS: 7181-71-7) is a chemical compound with molecular formula C11H10I3NO3 and molecular weight 584.91 g/mol. Its IUPAC systematic name is 3-(butanoylamino)-2,4,6-triiodobenzoic acid. LogP 3.4 Topological Polar Surface Area 66.4 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 3 Rotatable Bonds 4 Exact Mass 584.7795 Heavy Atoms 18 Complexity 327.0 InChI Key: QEKXGWMRPSGUEC-UHFFFAOYSA-N. SMILES: CCCC(=O)NC1=C(C=C(C(=C1I)C(=O)O)I)I.

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We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.

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