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Details

Stereochemistry ACHIRAL
Molecular Formula C7H7ClS
Molecular Weight 158.648
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-CHLOROPHENYL METHYL SULFIDE

SMILES

CSC1=CC=C(Cl)C=C1

InChI

InChIKey=KIQQUVJOLVCZKG-UHFFFAOYSA-N
InChI=1S/C7H7ClS/c1-9-7-4-2-6(8)3-5-7/h2-5H,1H3

HIDE SMILES / InChI

Molecular Formula C7H7ClS
Molecular Weight 158.648
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Treatment of facial atrophic scars with Esthélis, a hyaluronic acid filler with polydense cohesive matrix (CPM).
2010-12
Improved expression of recombinant cytochrome P450 monooxygenase in Escherichia coli for asymmetric oxidation of sulfides.
2010-11
Sequence analysis and heterologous expression of a new cytochrome P450 monooxygenase from Rhodococcus sp. for asymmetric sulfoxidation.
2010-01
Determination of the sulphoxides and sulphones of three simple sulphides in rat urine: effects of phenobarbitone, beta-naphthoflavone and methimazole.
2005-01
Involvement of cytochrome P450 and the flavin-containing monooxygenase(s) in the sulphoxidation of simple sulphides in human liver microsomes.
2003-06-06
HPLC analysis of 4-chlorophenyl methyl sulphide and diphenyl sulphide and their corresponding sulphoxides and sulphones in rat liver microsomes.
2002-01-01
Substance Class Chemical
Created
by admin
on Mon Mar 31 21:58:21 GMT 2025
Edited
by admin
on Mon Mar 31 21:58:21 GMT 2025
Record UNII
031E43FWKK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-72090
Preferred Name English
4-CHLOROPHENYL METHYL SULFIDE
Systematic Name English
METHYL 4-CHLOROPHENYL SULFIDE
Systematic Name English
P-(METHYLTHIO)CHLOROBENZENE
Common Name English
SULFIDE, P-CHLOROPHENYL METHYL
Common Name English
4-CHLOROTHIOANISOLE
Systematic Name English
4-METHYLTHIO-1-CHLOROBENZENE
Systematic Name English
P-CHLOROPHENYL METHYL SULFIDE
Common Name English
P-CHLOROTHIOANISOLE
Common Name English
METHYL P-CHLOROPHENYL SULFIDE
Common Name English
1-CHLORO-4-(METHYLTHIO)BENZENE
Systematic Name English
BENZENE, 1-CHLORO-4-(METHYLTHIO)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID8023973
Created by admin on Mon Mar 31 21:58:21 GMT 2025 , Edited by admin on Mon Mar 31 21:58:21 GMT 2025
PRIMARY
FDA UNII
031E43FWKK
Created by admin on Mon Mar 31 21:58:21 GMT 2025 , Edited by admin on Mon Mar 31 21:58:21 GMT 2025
PRIMARY
ECHA (EC/EINECS)
204-600-5
Created by admin on Mon Mar 31 21:58:21 GMT 2025 , Edited by admin on Mon Mar 31 21:58:21 GMT 2025
PRIMARY
PUBCHEM
31243
Created by admin on Mon Mar 31 21:58:21 GMT 2025 , Edited by admin on Mon Mar 31 21:58:21 GMT 2025
PRIMARY
NSC
72090
Created by admin on Mon Mar 31 21:58:21 GMT 2025 , Edited by admin on Mon Mar 31 21:58:21 GMT 2025
PRIMARY
CAS
123-09-1
Created by admin on Mon Mar 31 21:58:21 GMT 2025 , Edited by admin on Mon Mar 31 21:58:21 GMT 2025
PRIMARY