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Details

Stereochemistry ACHIRAL
Molecular Formula C8H4I3NO4
Molecular Weight 558.8351
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-Amino-2,4,6-triiodoisophthalic acid

SMILES

NC1=C(I)C(C(O)=O)=C(I)C(C(O)=O)=C1I

InChI

InChIKey=JEZJSNULLBSYHV-UHFFFAOYSA-N
InChI=1S/C8H4I3NO4/c9-3-1(7(13)14)4(10)6(12)5(11)2(3)8(15)16/h12H2,(H,13,14)(H,15,16)

HIDE SMILES / InChI

Molecular Formula C8H4I3NO4
Molecular Weight 558.8351
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
4-(4-Pyrid-yl)pyridinium 3-amino-5-carb-oxy-2,4,6-triiodo-benzoate-5-amino-2,4,6-triiodo-isophthalic acid (1/1).
2010-11-13
catena-Poly[[dipyridine-cadmium(II)]-μ-5-amino-2,4,6-triiodo-isophthalato].
2010-10-09
How to get the magic triangle and the MAD triangle into your protein crystal.
2009-10-01
Polymorphism in high-crystalline-stability metal-organic nanotubes.
2009-06-01
A magic triangle for experimental phasing of macromolecules.
2008-11
Structure determination of the cancer-associated Mycoplasma hyorhinis protein Mh-p37.
2008-11
A metal-organic nanotube exhibiting reversible adsorption of (H2O)12 cluster.
2008-10-29
catena-Poly[[[aqua-tripyridine-cobalt(II)]-μ-5-amino-2,4,6-triiodoisophthalato-κO:O] pyridine solvate].
2008-10-15
catena-Poly[[dipyridine-mercury(II)]-μ-5-amino-2,4,6-triiodo-isophthalato].
2008-09-27
5-Amino-2,4,6-triiodo-isophthalic acid monohydrate.
2008-06-19
The mineralization of 5-amino-2,4,6-triiodoisophthalic acid by a two-stage fixed-bed reactor.
2008-05
Enrichment and properties of an anaerobic mixed culture that reductively deiodinates 5-amino-2,4,6-triiodoisophthalic acid, an X-ray contrast agent precursor.
2003-10
Phylogenetic analysis of an anaerobic microbial consortium deiodinating 5-amino-2,4,6-triiodoisophthalic acid.
2003-09
Patents
Substance Class Chemical
Created
by admin
on Mon Mar 31 22:59:41 GMT 2025
Edited
by admin
on Mon Mar 31 22:59:41 GMT 2025
Record UNII
A17G990RT0
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,3-BENZENEDICARBOXYLIC ACID, 5-AMINO-2,4,6-TRIIODO-
Preferred Name English
5-Amino-2,4,6-triiodoisophthalic acid
Systematic Name English
IOHEXOL IMPURITY K [EP IMPURITY]
Common Name English
2,4,6-TRIIODO-5-AMINOISOPHTHALIC ACID
Systematic Name English
5-AMINO-2,4,6-TRIIODOBENZENE-1,3-DICARBOXYLIC ACID
Systematic Name English
5-AMINO-2,4,6-TRIIODO-1,3-BENZENEDICARBOXYLIC ACID
Systematic Name English
ISOPHTHALIC ACID, 5-AMINO-2,4,6-TRIIODO-
Common Name English
Code System Code Type Description
FDA UNII
A17G990RT0
Created by admin on Mon Mar 31 22:59:41 GMT 2025 , Edited by admin on Mon Mar 31 22:59:41 GMT 2025
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CAS
35453-19-1
Created by admin on Mon Mar 31 22:59:41 GMT 2025 , Edited by admin on Mon Mar 31 22:59:41 GMT 2025
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EPA CompTox
DTXSID10188969
Created by admin on Mon Mar 31 22:59:41 GMT 2025 , Edited by admin on Mon Mar 31 22:59:41 GMT 2025
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PUBCHEM
3015783
Created by admin on Mon Mar 31 22:59:41 GMT 2025 , Edited by admin on Mon Mar 31 22:59:41 GMT 2025
PRIMARY
ECHA (EC/EINECS)
252-575-4
Created by admin on Mon Mar 31 22:59:41 GMT 2025 , Edited by admin on Mon Mar 31 22:59:41 GMT 2025
PRIMARY