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Details

Stereochemistry ACHIRAL
Molecular Formula C9H12OS
Molecular Weight 168.256
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-METHYL-4-(METHYLTHIO)ANISOLE

SMILES

COC1=CC=C(SC)C(C)=C1

InChI

InChIKey=FPJQQPOPOJLVNT-UHFFFAOYSA-N
InChI=1S/C9H12OS/c1-7-6-8(10-2)4-5-9(7)11-3/h4-6H,1-3H3

HIDE SMILES / InChI

Molecular Formula C9H12OS
Molecular Weight 168.256
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 Fri Dec 15 19:14:00 GMT 2023
Edited
by admin
on Fri Dec 15 19:14:00 GMT 2023
Record UNII
6T4RVE924I
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-METHYL-4-(METHYLTHIO)ANISOLE
Systematic Name English
BENZENE, 4-METHOXY-2-METHYL-1-(METHYLTHIO)-
Systematic Name English
ANISOLE, 3-METHYL-4-(METHYLTHIO)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID80177108
Created by admin on Fri Dec 15 19:14:00 GMT 2023 , Edited by admin on Fri Dec 15 19:14:00 GMT 2023
PRIMARY
CAS
22583-04-6
Created by admin on Fri Dec 15 19:14:00 GMT 2023 , Edited by admin on Fri Dec 15 19:14:00 GMT 2023
PRIMARY
PUBCHEM
597806
Created by admin on Fri Dec 15 19:14:00 GMT 2023 , Edited by admin on Fri Dec 15 19:14:00 GMT 2023
PRIMARY
FDA UNII
6T4RVE924I
Created by admin on Fri Dec 15 19:14:00 GMT 2023 , Edited by admin on Fri Dec 15 19:14:00 GMT 2023
PRIMARY