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Details

Stereochemistry ACHIRAL
Molecular Formula C7H5Cl3O
Molecular Weight 211.473
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,4,6-TRICHLORO-M-CRESOL

SMILES

CC1=C(Cl)C(O)=C(Cl)C=C1Cl

InChI

InChIKey=QTAATZDGGZYBDC-UHFFFAOYSA-N
InChI=1S/C7H5Cl3O/c1-3-4(8)2-5(9)7(11)6(3)10/h2,11H,1H3

HIDE SMILES / InChI

Molecular Formula C7H5Cl3O
Molecular Weight 211.473
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Formation of dimer-type ketals in the reaction of 2,4,6-trichlorophenol and 2,4,6-trichloro-m-cresol with calcium hypochlorite in methanol: conversion to quinones and other compounds.
2002 Sep 20
Investigations of the reactions of monochloramine and dichloramine with selected phenols: examination of humic acid models and water contaminants.
2004 Oct 1
Substance Class Chemical
Created
by admin
on Sat Dec 16 01:21:57 GMT 2023
Edited
by admin
on Sat Dec 16 01:21:57 GMT 2023
Record UNII
D0H0QF5KL9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,4,6-TRICHLORO-M-CRESOL
MI  
Systematic Name English
2,4,6-TRICHLORO-M-CRESOL [MI]
Common Name English
M-CRESOL, 2,4,6-TRICHLORO-
Systematic Name English
PHENOL, 2,4,6-TRICHLORO-3-METHYL-
Systematic Name English
2,4,6-TRICHLORO-3-METHYLPHENOL
Systematic Name English
Code System Code Type Description
PUBCHEM
11085
Created by admin on Sat Dec 16 01:21:57 GMT 2023 , Edited by admin on Sat Dec 16 01:21:57 GMT 2023
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MERCK INDEX
m11070
Created by admin on Sat Dec 16 01:21:57 GMT 2023 , Edited by admin on Sat Dec 16 01:21:57 GMT 2023
PRIMARY Merck Index
CAS
551-76-8
Created by admin on Sat Dec 16 01:21:57 GMT 2023 , Edited by admin on Sat Dec 16 01:21:57 GMT 2023
PRIMARY
FDA UNII
D0H0QF5KL9
Created by admin on Sat Dec 16 01:21:57 GMT 2023 , Edited by admin on Sat Dec 16 01:21:57 GMT 2023
PRIMARY
EPA CompTox
DTXSID30203623
Created by admin on Sat Dec 16 01:21:57 GMT 2023 , Edited by admin on Sat Dec 16 01:21:57 GMT 2023
PRIMARY