2,3,5,6-TETRACHLOROANISOLE

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NCATS

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 2,3,5,6-TETRACHLOROANISOLE

Structure Search

SMILES

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

InChI

InChIKey=WMMFIDNWZNCBCT-UHFFFAOYSA-N

InChI=1S/C7H4Cl4O/c1-12-7-5(10)3(8)2-4(9)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

Title	Date	PubMed
Comparison of two SPME fibers for the extraction of some off-flavor cork-taint compounds in bottled wines investigated by GC-HRMS.	2009-04	19190895

Substance Class	Chemical Created by `admin` on `Mon Mar 31 18:58:09 GMT 2025` Edited by `admin` on `Mon Mar 31 18:58:09 GMT 2025`
Record UNII	64764RMB8N
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

NSC-21468

Preferred Name

English

2,3,5,6-TETRACHLOROANISOLE

Systematic Name

English

BENZENE, 1,2,4,5-TETRACHLORO-3-METHOXY-

Systematic Name

English

ANISOLE, 2,3,5,6-TETRACHLORO-

Systematic Name

English

Code System Code Type Description

CAS

6936-40-9

Created by admin on Mon Mar 31 18:58:09 GMT 2025 , Edited by admin on Mon Mar 31 18:58:09 GMT 2025

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NSC

21468

Created by admin on Mon Mar 31 18:58:09 GMT 2025 , Edited by admin on Mon Mar 31 18:58:09 GMT 2025

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EPA CompTox

DTXSID30863963

Created by admin on Mon Mar 31 18:58:09 GMT 2025 , Edited by admin on Mon Mar 31 18:58:09 GMT 2025

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PUBCHEM

40774

Created by admin on Mon Mar 31 18:58:09 GMT 2025 , Edited by admin on Mon Mar 31 18:58:09 GMT 2025

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FDA UNII

64764RMB8N

Created by admin on Mon Mar 31 18:58:09 GMT 2025 , Edited by admin on Mon Mar 31 18:58:09 GMT 2025

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ECHA (EC/EINECS)

230-061-0

Created by admin on Mon Mar 31 18:58:09 GMT 2025 , Edited by admin on Mon Mar 31 18:58:09 GMT 2025

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