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Details

Stereochemistry ACHIRAL
Molecular Formula C12H5Cl3O2
Molecular Weight 287.526
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,2,4-TRICHLORODIBENZO-P-DIOXIN

SMILES

ClC1=CC(Cl)=C2OC3=C(OC2=C1Cl)C=CC=C3

InChI

InChIKey=HRVUKLBFRPWXPJ-UHFFFAOYSA-N
InChI=1S/C12H5Cl3O2/c13-6-5-7(14)11-12(10(6)15)17-9-4-2-1-3-8(9)16-11/h1-5H

HIDE SMILES / InChI

Molecular Formula C12H5Cl3O2
Molecular Weight 287.526
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Specific interactions between aryl hydrocarbon receptor and dioxin congeners: ab initio fragment molecular orbital calculations.
2010-09
Carbon isotope fractionation during dechlorination of 1,2,3,4-tetrachlorodibenzo-p-dioxin by a Dehalococcoides-containing culture.
2010-08
Enrichment of a dioxin-dehalogenating Dehalococcoides species in two-liquid phase cultures.
2008-10
Kinetics of reductive dechlorination of 1,2,3,4-TCDD in the presence of zero-valent zinc.
2008-03
Dehalococcoides ethenogenes strain 195 reductively dechlorinates diverse chlorinated aromatic pollutants.
2004-04-01
Properties of a trichlorodibenzo-p-dioxin-dechlorinating mixed culture with a Dehalococcoides as putative dechlorinating species.
2004-02-01
Regiospecific dechlorination of spiked tetra- and trichlorodibenzo-p-dioxins by anaerobic bacteria from PCDD/F-contaminated Spittelwasser sediments.
2001-05-25
Substance Class Chemical
Created
by admin
on Mon Mar 31 19:39:18 GMT 2025
Edited
by admin
on Mon Mar 31 19:39:18 GMT 2025
Record UNII
N788AO107G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PCDD 14
Preferred Name English
1,2,4-TRICHLORODIBENZO-P-DIOXIN
Common Name English
1,2,4-TRICHLORODIBENZODIOXIN
Systematic Name English
DIBENZO(B,E)(1,4)DIOXIN, 1,2,4-TRICHLORO-
Systematic Name English
Code System Code Type Description
PUBCHEM
38253
Created by admin on Mon Mar 31 19:39:18 GMT 2025 , Edited by admin on Mon Mar 31 19:39:18 GMT 2025
PRIMARY
EPA CompTox
DTXSID50192489
Created by admin on Mon Mar 31 19:39:18 GMT 2025 , Edited by admin on Mon Mar 31 19:39:18 GMT 2025
PRIMARY
FDA UNII
N788AO107G
Created by admin on Mon Mar 31 19:39:18 GMT 2025 , Edited by admin on Mon Mar 31 19:39:18 GMT 2025
PRIMARY
CAS
39227-58-2
Created by admin on Mon Mar 31 19:39:18 GMT 2025 , Edited by admin on Mon Mar 31 19:39:18 GMT 2025
PRIMARY