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

Details

Stereochemistry ACHIRAL
Molecular Formula C6H8O2
Molecular Weight 112.1265
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5,5-DIMETHYL-2(5H)-FURANONE

SMILES

CC1(C)OC(=O)C=C1

InChI

InChIKey=YNKQMZRTPPVLLL-UHFFFAOYSA-N
InChI=1S/C6H8O2/c1-6(2)4-3-5(7)8-6/h3-4H,1-2H3

HIDE SMILES / InChI

Molecular Formula C6H8O2
Molecular Weight 112.1265
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 19:30:07 GMT 2025
Edited
by admin
on Mon Mar 31 19:30:07 GMT 2025
Record UNII
0HJB56V40L
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-PENTENOIC ACID, 4-HYDROXY-4-METHYL-, .GAMMA.-LACTONE
Preferred Name English
5,5-DIMETHYL-2(5H)-FURANONE
Systematic Name English
4-HYDROXY-4-METHYL-2-PENTENOIC ACID LACTONE
Common Name English
2(5H)-FURANONE, 5,5-DIMETHYL-
Systematic Name English
4,4-DIMETHYLBUT-2-EN-4-OLIDE
Common Name English
2,2-DIMETHYL-5-OXO-2,5-DIHYDROFURAN
Systematic Name English
4,4-DIMETHYL-2-BUTENOLIDE
Common Name English
Code System Code Type Description
PUBCHEM
29909
Created by admin on Mon Mar 31 19:30:07 GMT 2025 , Edited by admin on Mon Mar 31 19:30:07 GMT 2025
PRIMARY
FDA UNII
0HJB56V40L
Created by admin on Mon Mar 31 19:30:07 GMT 2025 , Edited by admin on Mon Mar 31 19:30:07 GMT 2025
PRIMARY
CAS
20019-64-1
Created by admin on Mon Mar 31 19:30:07 GMT 2025 , Edited by admin on Mon Mar 31 19:30:07 GMT 2025
PRIMARY
EPA CompTox
DTXSID90173833
Created by admin on Mon Mar 31 19:30:07 GMT 2025 , Edited by admin on Mon Mar 31 19:30:07 GMT 2025
PRIMARY