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Structure

Benzeneacetic acid,a-ethyl-2,4,6-triiodo-3-[(1-oxobutyl)amino]-

CAS
29067-72-9
Catalog Number
ACM29067729
Category
Other Products
Molecular Weight
626.9951
Molecular Formula
C14H16I3NO3

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Specification

Synonyms
BRN 3006554, CID34456, LS-47893, 2-(3-Butyramido-2,4,6-triiodophenyl)butyric acid, BUTYRIC ACID, 2-(3-BUTYRAMIDO-2,4,6-TRIIODOPHENYL)-, 29067-72-9
IUPAC Name
2-[3-(butanoylamino)-2,4,6-triiodophenyl]butanoic acid
Canonical SMILES
CCCC(=O)NC1=C(C=C(C(=C1I)C(CC)C(=O)O)I)I
InChI Key
OCJFLSKQLCGZIF-UHFFFAOYSA-N
Boiling Point
600ºC at 760mmHg
Flash Point
316.7ºC
Density
2.215g/cm³
Exact Mass
626.82600
H-Bond Acceptor
3
H-Bond Donor
2
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