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Details

Stereochemistry RACEMIC
Molecular Formula C10H14O2S
Molecular Weight 198.282
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-FURFURYLTHIO-2-PENTANONE

SMILES

CC(CC(C)=O)SCC1=CC=CO1

InChI

InChIKey=IUNKNKANRUMCNL-UHFFFAOYSA-N
InChI=1S/C10H14O2S/c1-8(11)6-9(2)13-7-10-4-3-5-12-10/h3-5,9H,6-7H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C10H14O2S
Molecular Weight 198.282
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Mon Mar 31 19:01:32 GMT 2025
Edited
by admin
on Mon Mar 31 19:01:32 GMT 2025
Record UNII
W5N093JFRP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-FURFURYLTHIO-2-PENTANONE
Systematic Name English
FEMA NO. 3840
Preferred Name English
4-((2-FURANMETHYL)THIO)PENTAN-2-ONE
Common Name English
(±)-4-FURFURYLTHIO-2-PENTANONE
Systematic Name English
4-((2-FURANMETHYL)THIO)-2-PENTANONE [FHFI]
Common Name English
4-(FURAN-2-YLMETHYLSULFANYL)PENTANE-2-ONE
Systematic Name English
4-FURFURYLTHIO-2-PENTANONE, (±)-
Systematic Name English
Code System Code Type Description
JECFA MONOGRAPH
1016
Created by admin on Mon Mar 31 19:01:32 GMT 2025 , Edited by admin on Mon Mar 31 19:01:32 GMT 2025
PRIMARY
FDA UNII
W5N093JFRP
Created by admin on Mon Mar 31 19:01:32 GMT 2025 , Edited by admin on Mon Mar 31 19:01:32 GMT 2025
PRIMARY
CAS
180031-78-1
Created by admin on Mon Mar 31 19:01:32 GMT 2025 , Edited by admin on Mon Mar 31 19:01:32 GMT 2025
PRIMARY
EPA CompTox
DTXSID40870148
Created by admin on Mon Mar 31 19:01:32 GMT 2025 , Edited by admin on Mon Mar 31 19:01:32 GMT 2025
PRIMARY
PUBCHEM
3025939
Created by admin on Mon Mar 31 19:01:32 GMT 2025 , Edited by admin on Mon Mar 31 19:01:32 GMT 2025
PRIMARY