4,5,6-TRICHLOROGUAIACOL

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H5Cl3O2
Molecular Weight	227.472
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4,5,6-TRICHLOROGUAIACOL

Structure Search

SMILES

COC1=CC(Cl)=C(Cl)C(Cl)=C1O

InChI

InChIKey=NIAJPNQTKGWEOI-UHFFFAOYSA-N

InChI=1S/C7H5Cl3O2/c1-12-4-2-3(8)5(9)6(10)7(4)11/h2,11H,1H3

HIDE SMILES / InChI

Molecular Formula	C7H5Cl3O2
Molecular Weight	227.472
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 16:43:22 GMT 2025` Edited by `admin` on `Tue Apr 01 16:43:22 GMT 2025`
Record UNII	39Q8MK30WF
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

4,5,6-TRICHLOROGUAIACOL

Systematic Name

English

2,3,4-TRICHLORO-6-METHOXYPHENOL

Preferred Name

English

2-METHOXY-4,5,6-TRICHLOROPHENOL

Systematic Name

English

Code System Code Type Description

PUBCHEM

17577

Created by admin on Tue Apr 01 16:43:22 GMT 2025 , Edited by admin on Tue Apr 01 16:43:22 GMT 2025

PRIMARY

EPA CompTox

DTXSID00858745

Created by admin on Tue Apr 01 16:43:22 GMT 2025 , Edited by admin on Tue Apr 01 16:43:22 GMT 2025

PRIMARY

FDA UNII

39Q8MK30WF

Created by admin on Tue Apr 01 16:43:22 GMT 2025 , Edited by admin on Tue Apr 01 16:43:22 GMT 2025

PRIMARY

CAS

2668-24-8

Created by admin on Tue Apr 01 16:43:22 GMT 2025 , Edited by admin on Tue Apr 01 16:43:22 GMT 2025

PRIMARY

CAS

61966-36-7

Created by admin on Tue Apr 01 16:43:22 GMT 2025 , Edited by admin on Tue Apr 01 16:43:22 GMT 2025

NON-SPECIFIC SUBSTITUTION