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Details

Stereochemistry ACHIRAL
Molecular Formula C7H14OS
Molecular Weight 146.25
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(METHYLTHIO) HEXAN-3-ONE

SMILES

CCCC(=O)CCSC

InChI

InChIKey=FOBKZDVNAWSVRY-UHFFFAOYSA-N
InChI=1S/C7H14OS/c1-3-4-7(8)5-6-9-2/h3-6H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C7H14OS
Molecular Weight 146.25
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 Mon Mar 31 23:24:19 GMT 2025
Edited
by admin
on Mon Mar 31 23:24:19 GMT 2025
Record UNII
60A34I3MOI
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-HEXANONE, 1-(METHYLTHIO)-
Preferred Name English
1-(METHYLTHIO) HEXAN-3-ONE
Systematic Name English
Code System Code Type Description
FDA UNII
60A34I3MOI
Created by admin on Mon Mar 31 23:24:19 GMT 2025 , Edited by admin on Mon Mar 31 23:24:19 GMT 2025
PRIMARY
PUBCHEM
64164036
Created by admin on Mon Mar 31 23:24:19 GMT 2025 , Edited by admin on Mon Mar 31 23:24:19 GMT 2025
PRIMARY
CAS
560095-87-6
Created by admin on Mon Mar 31 23:24:19 GMT 2025 , Edited by admin on Mon Mar 31 23:24:19 GMT 2025
PRIMARY