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Details

Stereochemistry ACHIRAL
Molecular Formula C8H6O4
Molecular Weight 166.1308
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ISOPHTHALIC ACID

SMILES

OC(=O)C1=CC(=CC=C1)C(O)=O

InChI

InChIKey=QQVIHTHCMHWDBS-UHFFFAOYSA-N
InChI=1S/C8H6O4/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4H,(H,9,10)(H,11,12)

HIDE SMILES / InChI

Molecular Formula C8H6O4
Molecular Weight 166.1308
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
[Determination of isophthalic acid in polyethylene glycol terephthalate fiber by high performance liquid chromatography].
2001 Jul
Protein kinase G activation of K(ATP) channels in human-cultured prostatic stromal cells.
2002 Dec
[V(III)(H2O)]3O(O2CC6H4CO2)3.(Cl, 9H2O) (MIL-59): a rare example of vanadocarboxylate with a magnetically frustrated three-dimensional hybrid framework.
2002 Jul 21
A mixed-valence copper coordination polymer generated by hydrothermal metal/ligand redox reactions.
2002 Jul 7
Kagomé lattice: A molecular toolkit for magnetism.
2002 Oct
Double-stranded helices and molecular zippers assembled from single-stranded coordination polymers directed by supramolecular interactions.
2002 Oct 18
Dendronized molecular knots: selective synthesis of various generations, enantiomer separation, circular dichroism.
2002 Oct 4
[Polyethylene terephthalate (PET)--health aspects and food packaging application].
2003
Regulation of Ca2+ signaling by Na+ pump alpha-2 subunit expression.
2003 Apr
4-aminopyridine decreases progesterone production by porcine granulosa cells.
2003 Apr 1
Involvement of mitochondrial K+ release and cellular efflux in ischemic and apoptotic neuronal death.
2003 Aug
[[Ca5(C8H4O4)5(H2O)9].8H2O]n: the first crystallographically characterized non-transition metal salt of isophthalic acid.
2003 Dec
Self-assembly of dialkyltin(IV) moieties and aromatic dicarboxylates to complexes with a polymeric or a discrete trinuclear macrocyclic structure in the solid state and a mixture of fast interchanging cyclooligomeric structures in solution.
2003 Jun 16
Solvent extraction of organic molecules of exobiological interest for in situ analysis of the Martian soil.
2003 May 30
A porous supramolecular architecture from a copper(II) coordination polymer with a 3D four-connected 8(6) net.
2003 Nov 17
Delftia tsuruhatensis sp. nov., a terephthalate-assimilating bacterium isolated from activated sludge.
2003 Sep
Phylogenetic analysis of an anaerobic microbial consortium deiodinating 5-amino-2,4,6-triiodoisophthalic acid.
2003 Sep
Poly[[bis(pyridine-kappaN)copper(II)]-mu(3)-5-hydroxyisophthalato-kappa3O:O':O''].
2004 Dec
Poly[[[(1,10-phenanthroline-kappa2N,N')zinc(II)]-mu3-5-hydroxyisophthalato-kappa4O,O':O":O"'] monohydrate].
2004 Jul
Synthesis, structure and luminescent properties of yttrium benzene dicarboxylates with one- and three-dimensional structure.
2004 Sep 21
Biochemical pathway and degradation of phthalate ester isomers by bacteria.
2005
Uptake of sodium in quince, sugar beet, and wheat protoplasts determined by the fluorescent sodium-binding dye benzofuran isophthalate.
2005 Apr
Isophthalato-based 2D coordination polymers of Eu(III), Gd(III), and Tb(III): enhancement of the terbium-centered luminescence through thiophene derivatization.
2005 Apr 18
Allosteric NADP-glutamate dehydrogenase from aspergilli: purification, characterization and implications for metabolic regulation at the carbon-nitrogen interface.
2005 May
Metal-organic frameworks based on trigonal prismatic building blocks and the new "acs" topology.
2005 May 2
Degradation of phthalic acids and benzoic acid from terephthalic acid wastewater by advanced oxidation processes.
2006
Pelotomaculum terephthalicum sp. nov. and Pelotomaculum isophthalicum sp. nov.: two anaerobic bacteria that degrade phthalate isomers in syntrophic association with hydrogenotrophic methanogens.
2006 Apr
Design and evaluation of 16S rRNA sequence based oligonucleotide probes for the detection and quantification of Comamonas testosteroni in mixed microbial communities.
2006 Jun 13
Direct effects of aldosterone on cardiomyocytes in the presence of normal and elevated extracellular sodium.
2006 Mar
Anion binding versus intramolecular hydrogen bonding in neutral macrocyclic amides.
2006 Oct 10
Hydrolytic stability of terephthaloyl chloride and isophthaloyl chloride.
2006 Oct 15
Induction of apoptosis by intracellular potassium ion depletion: using the fluorescent dye PBFI in a 96-well plate method in cultured lung cancer cells.
2006 Sep
Organic-acid effect on the structures of a series of lead(II) complexes.
2007 Aug 6
Conformational control of transmembrane Cl(-) transport.
2007 Feb 21
Hydrothermal syntheses, crystal structures and magnetic properties of two copper(II) complexes involved in situ ligand synthesis.
2007 Jul 28
Molecular tectonics of mixed-ligand metal-organic frameworks: positional isomeric effect, metal-directed assembly, and structural diversification.
2007 May 14
Thiourea-based molecular clips for fluorescent discrimination of isomeric dicarboxylates.
2007 Nov 7
Organically templated metal-organic framework with 2-fold interpenetrated {3(3).5(9).6(3)}-lcy net.
2008 Jun 14
Syntheses, structures and luminescent properties of zinc(II) and cadmium(II) coordination complexes based on new bis(imidazolyl)ether and different carboxylate ligands.
2008 Jun 21
Efficient near-UV photosensitization of the Tb(III) green luminescence by use of 2-hydroxyisophthalate ligands.
2008 Jun 28
Syntheses, structures and properties of cadmium benzenedicarboxylate metal-organic frameworks.
2008 May 14
Zinc(II) tetraarylporphyrins anchored to TiO2, ZnO, and ZrO2 nanoparticle films through rigid-rod linkers.
2008 May 20
A designed metal-organic framework based on a metal-organic polyhedron.
2008 May 28
Carbon source-dependent modulation of NADP-glutamate dehydrogenases in isophthalate-degrading Pseudomonas aeruginosa strain PP4, Pseudomonas strain PPD and Acinetobacter lwoffii strain ISP4.
2008 Nov
Adhesion forces between Staphylococcus epidermidis and surfaces bearing self-assembled monolayers in the presence of model proteins.
2008 Nov
New heterometallic carboxylate frameworks: synthesis, structure, robustness, flexibility, and porosity.
2009 Aug 17
Sample stacking for determination of aromatic acid impurities by microemulsion electrokinetic chromatography.
2009 Jan 19
Crystal structures and solid-state CPMAS 13C NMR correlations in luminescent zinc(II) and cadmium(II) mixed-ligand coordination polymers constructed from 1,2-bis(1,2,4-triazol-4-yl)ethane and benzenedicarboxylate.
2009 Mar 14
Isoreticular metal-organic polyhedral networks based on 5-connecting paddlewheel motifs.
2009 Mar 2
Determining organic impurities in mother liquors from oxidative terephthalic acid synthesis by microemulsion electrokinetic chromatography.
2009 Mar 20
Patents
Substance Class Chemical
Created
by admin
on Thu Jul 06 03:15:01 UTC 2023
Edited
by admin
on Thu Jul 06 03:15:01 UTC 2023
Record UNII
X35216H9FJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ISOPHTHALIC ACID
HSDB   MI  
Systematic Name English
M-CARBOXYBENZOIC ACID
Systematic Name English
BENZENE-1,3-DICARBOXYLIC ACID
Systematic Name English
ISOPHTHALIC ACID [HSDB]
Common Name English
M-PHTHALIC ACID
Common Name English
3-CARBOXYBENZOIC ACID
Systematic Name English
NSC-15310
Code English
ISOTEREPHTHALIC ACID
Common Name English
ISOPHTHALIC ACID [INCI]
Common Name English
ISOPHTHALATE
Systematic Name English
M-BENZENEDICARBOXYLIC ACID
Common Name English
1,3-BENZENEDICARBOXYLIC ACID
Systematic Name English
M-DICARBOXYBENZENE
Systematic Name English
ISOPHTHALIC ACID [MI]
Common Name English
Classification Tree Code System Code
Food Contact Sustance Notif, (FCN No.) FCN NO. 211
Created by admin on Thu Jul 06 03:15:01 UTC 2023 , Edited by admin on Thu Jul 06 03:15:01 UTC 2023
Food Contact Sustance Notif, (FCN No.) FCN NO, 4
Created by admin on Thu Jul 06 03:15:01 UTC 2023 , Edited by admin on Thu Jul 06 03:15:01 UTC 2023
Code System Code Type Description
NSC
15310
Created by admin on Thu Jul 06 03:15:01 UTC 2023 , Edited by admin on Thu Jul 06 03:15:01 UTC 2023
PRIMARY
HSDB
2090
Created by admin on Thu Jul 06 03:15:01 UTC 2023 , Edited by admin on Thu Jul 06 03:15:01 UTC 2023
PRIMARY
MERCK INDEX
M6513
Created by admin on Thu Jul 06 03:15:01 UTC 2023 , Edited by admin on Thu Jul 06 03:15:01 UTC 2023
PRIMARY Merck Index
WIKIPEDIA
ISOPHTHALIC ACID
Created by admin on Thu Jul 06 03:15:01 UTC 2023 , Edited by admin on Thu Jul 06 03:15:01 UTC 2023
PRIMARY
CHEBI
30802
Created by admin on Thu Jul 06 03:15:01 UTC 2023 , Edited by admin on Thu Jul 06 03:15:01 UTC 2023
PRIMARY
ECHA (EC/EINECS)
204-506-4
Created by admin on Thu Jul 06 03:15:01 UTC 2023 , Edited by admin on Thu Jul 06 03:15:01 UTC 2023
PRIMARY
FDA UNII
X35216H9FJ
Created by admin on Thu Jul 06 03:15:01 UTC 2023 , Edited by admin on Thu Jul 06 03:15:01 UTC 2023
PRIMARY
CAS
121-91-5
Created by admin on Thu Jul 06 03:15:01 UTC 2023 , Edited by admin on Thu Jul 06 03:15:01 UTC 2023
PRIMARY
CHEBI
30803
Created by admin on Thu Jul 06 03:15:01 UTC 2023 , Edited by admin on Thu Jul 06 03:15:01 UTC 2023
PRIMARY
PUBCHEM
8496
Created by admin on Thu Jul 06 03:15:01 UTC 2023 , Edited by admin on Thu Jul 06 03:15:01 UTC 2023
PRIMARY
EPA CompTox
DTXSID3021485
Created by admin on Thu Jul 06 03:15:01 UTC 2023 , Edited by admin on Thu Jul 06 03:15:01 UTC 2023
PRIMARY
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