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Details

Stereochemistry ACHIRAL
Molecular Formula C7H7ClO
Molecular Weight 142.583
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-CHLORO-4-METHYLPHENOL

SMILES

CC1=CC(Cl)=C(O)C=C1

InChI

InChIKey=AQJFATAFTQCRGC-UHFFFAOYSA-N
InChI=1S/C7H7ClO/c1-5-2-3-7(9)6(8)4-5/h2-4,9H,1H3

HIDE SMILES / InChI

Molecular Formula C7H7ClO
Molecular Weight 142.583
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Metabolism of 2-chloro-4-methylphenoxyacetate by Alcaligenes eutrophus JMP 134.
1993
Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods.
2006 Nov
N-Benzyl-2-(2-chloro-4-methyl-phen-oxy)acetamide.
2008 Jul 26
Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 08:51:32 GMT 2023
Edited
by admin
on Sat Dec 16 08:51:32 GMT 2023
Record UNII
1J012K1LJC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-CHLORO-4-METHYLPHENOL
Systematic Name English
NSC-48848
Code English
P-CRESOL, 2-CHLORO-
Common Name English
3-CHLORO-4-HYDROXYTOLUENE
Systematic Name English
2-CHLORO-P-CRESOL
Common Name English
PHENOL, 2-CHLORO-4-METHYL-
Systematic Name English
Code System Code Type Description
FDA UNII
1J012K1LJC
Created by admin on Sat Dec 16 08:51:32 GMT 2023 , Edited by admin on Sat Dec 16 08:51:32 GMT 2023
PRIMARY
ECHA (EC/EINECS)
229-656-8
Created by admin on Sat Dec 16 08:51:32 GMT 2023 , Edited by admin on Sat Dec 16 08:51:32 GMT 2023
PRIMARY
EPA CompTox
DTXSID5022512
Created by admin on Sat Dec 16 08:51:32 GMT 2023 , Edited by admin on Sat Dec 16 08:51:32 GMT 2023
PRIMARY
NSC
48848
Created by admin on Sat Dec 16 08:51:32 GMT 2023 , Edited by admin on Sat Dec 16 08:51:32 GMT 2023
PRIMARY
PUBCHEM
14851
Created by admin on Sat Dec 16 08:51:32 GMT 2023 , Edited by admin on Sat Dec 16 08:51:32 GMT 2023
PRIMARY
CAS
6640-27-3
Created by admin on Sat Dec 16 08:51:32 GMT 2023 , Edited by admin on Sat Dec 16 08:51:32 GMT 2023
PRIMARY