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Details

Stereochemistry ACHIRAL
Molecular Formula C7H4Cl4O
Molecular Weight 245.918
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,3,4,6-TETRACHLOROANISOLE

SMILES

COC1=C(Cl)C(Cl)=C(Cl)C=C1Cl

InChI

InChIKey=ITXDBGLYYSJNPK-UHFFFAOYSA-N
InChI=1S/C7H4Cl4O/c1-12-7-4(9)2-3(8)5(10)6(7)11/h2H,1H3

HIDE SMILES / InChI

Molecular Formula C7H4Cl4O
Molecular Weight 245.918
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Optimisation of a headspace solid-phase microextraction method for the direct determination of chloroanisoles related to cork taint in red wine.
2004 Nov 12
Determination of chloroanisole compounds in red wine by headspace solid-phase microextraction and gas chromatography-mass spectrometry.
2004 Oct 15
Quantification of chloroanisoles in cork using headspace solid-phase microextraction and gas chromatography with electron capture detection.
2006 Feb 24
Non-destructive method to determine halophenols and haloanisoles in cork stoppers by headspace sorptive extraction.
2006 May 12
Analysis for chloroanisoles and chlorophenols in cork by stir bar sorptive extraction and gas chromatography-mass spectrometry.
2007 Mar 30
Comparison of stir bar sorptive extraction and solid-phase microextraction to determine halophenols and haloanisoles by gas chromatography-ion trap tandem mass spectrometry.
2008 May 15
Haloanisole and halophenol contamination in Spanish aged red wines.
2009 Jan
Optimisation of a dispersive liquid-liquid microextraction method for the simultaneous determination of halophenols and haloanisoles in wines.
2010 Dec 3
Substance Class Chemical
Created
by admin
on Sat Dec 16 00:09:47 GMT 2023
Edited
by admin
on Sat Dec 16 00:09:47 GMT 2023
Record UNII
SJ2G6F3F2Y
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,3,4,6-TETRACHLOROANISOLE
Systematic Name English
BENZENE, 1,2,3,5-TETRACHLORO-4-METHOXY-
Systematic Name English
2,4,5,6-TETRACHLOROANISOLE
Systematic Name English
ANISOLE, 2,3,4,6-TETRACHLORO-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID80239654
Created by admin on Sat Dec 16 00:09:47 GMT 2023 , Edited by admin on Sat Dec 16 00:09:47 GMT 2023
PRIMARY
PUBCHEM
13647
Created by admin on Sat Dec 16 00:09:47 GMT 2023 , Edited by admin on Sat Dec 16 00:09:47 GMT 2023
PRIMARY
CAS
938-22-7
Created by admin on Sat Dec 16 00:09:47 GMT 2023 , Edited by admin on Sat Dec 16 00:09:47 GMT 2023
PRIMARY
FDA UNII
SJ2G6F3F2Y
Created by admin on Sat Dec 16 00:09:47 GMT 2023 , Edited by admin on Sat Dec 16 00:09:47 GMT 2023
PRIMARY