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Details

Stereochemistry ACHIRAL
Molecular Formula C11H16O2S
Molecular Weight 212.309
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,5-DIMETHYL-3-THIOISOVALERYLFURAN

SMILES

CC(C)CC(=O)SC1=C(C)OC(C)=C1

InChI

InChIKey=XFNLWIPNTYNNJX-UHFFFAOYSA-N
InChI=1S/C11H16O2S/c1-7(2)5-11(12)14-10-6-8(3)13-9(10)4/h6-7H,5H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C11H16O2S
Molecular Weight 212.309
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 18:56:53 GMT 2025
Edited
by admin
on Mon Mar 31 18:56:53 GMT 2025
Record UNII
L186I8YZ6T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,5-DIMETHYL-3-THIOISOVALERYLFURAN [FHFI]
Preferred Name English
2,5-DIMETHYL-3-THIOISOVALERYLFURAN
FHFI  
Systematic Name English
FEMA NO. 3482
Code English
BUTANETHIOIC ACID, 3-METHYL-, S-(2,5-DIMETHYL-3-FURANYL) ESTER
Common Name English
S-(2,5-DIMETHYL-3-FURYL) 3-METHYLBUTANETHIOATE
Systematic Name English
DIMETHYL-3-THIOISOVALERYLFURAN, 2,5-
Systematic Name English
ISOVALERIC ACID, THIO-, S-2,5-DIMETHYL-3-FURYL ESTER
Common Name English
3-(ISOVALERYLTHIO)-2,5-DIMETHYLFURAN
Systematic Name English
Code System Code Type Description
JECFA MONOGRAPH
1002
Created by admin on Mon Mar 31 18:56:53 GMT 2025 , Edited by admin on Mon Mar 31 18:56:53 GMT 2025
PRIMARY
PUBCHEM
41570
Created by admin on Mon Mar 31 18:56:53 GMT 2025 , Edited by admin on Mon Mar 31 18:56:53 GMT 2025
PRIMARY
CAS
55764-28-8
Created by admin on Mon Mar 31 18:56:53 GMT 2025 , Edited by admin on Mon Mar 31 18:56:53 GMT 2025
PRIMARY
FDA UNII
L186I8YZ6T
Created by admin on Mon Mar 31 18:56:53 GMT 2025 , Edited by admin on Mon Mar 31 18:56:53 GMT 2025
PRIMARY
EPA CompTox
DTXSID70204316
Created by admin on Mon Mar 31 18:56:53 GMT 2025 , Edited by admin on Mon Mar 31 18:56:53 GMT 2025
PRIMARY
ECHA (EC/EINECS)
259-802-6
Created by admin on Mon Mar 31 18:56:53 GMT 2025 , Edited by admin on Mon Mar 31 18:56:53 GMT 2025
PRIMARY