U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

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 3,5-DIMETHYL-4-METHYLSULFANYLPHENOL

SMILES

CSC1=C(C)C=C(O)C=C1C

InChI

InChIKey=JGFZITGNFAVSKU-UHFFFAOYSA-N
InChI=1S/C9H12OS/c1-6-4-8(10)5-7(2)9(6)11-3/h4-5,10H,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 19:10:48 GMT 2023
Edited
by admin
on Fri Dec 15 19:10:48 GMT 2023
Record UNII
D73AE3R9ZD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,5-DIMETHYL-4-METHYLSULFANYLPHENOL
Systematic Name English
METHYLTHIO)-3,5-XYLENOL, 4-
Common Name English
3,5-DIMETHYL-4-(METHYLTHIO)PHENOL
Systematic Name English
2,6-DIMETHYL-4-HYDROXYTHIOANISOLE
Systematic Name English
3,5-XYLENOL, 4-(METHYLTHIO)-
Systematic Name English
PHENOL, 3,5-DIMETHYL-4-(METHYLTHIO)-
Systematic Name English
4-METHYLSULFANYL-3,5-DIMETHYLPHENOL
Systematic Name English
Code System Code Type Description
PUBCHEM
81853
Created by admin on Fri Dec 15 19:10:48 GMT 2023 , Edited by admin on Fri Dec 15 19:10:48 GMT 2023
PRIMARY
FDA UNII
D73AE3R9ZD
Created by admin on Fri Dec 15 19:10:48 GMT 2023 , Edited by admin on Fri Dec 15 19:10:48 GMT 2023
PRIMARY
CAS
7379-51-3
Created by admin on Fri Dec 15 19:10:48 GMT 2023 , Edited by admin on Fri Dec 15 19:10:48 GMT 2023
PRIMARY
EPA CompTox
DTXSID9041497
Created by admin on Fri Dec 15 19:10:48 GMT 2023 , Edited by admin on Fri Dec 15 19:10:48 GMT 2023
PRIMARY
ECHA (EC/EINECS)
230-947-7
Created by admin on Fri Dec 15 19:10:48 GMT 2023 , Edited by admin on Fri Dec 15 19:10:48 GMT 2023
PRIMARY
CHEBI
38509
Created by admin on Fri Dec 15 19:10:48 GMT 2023 , Edited by admin on Fri Dec 15 19:10:48 GMT 2023
PRIMARY