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

Details

Stereochemistry RACEMIC
Molecular Formula C6H10O2
Molecular Weight 114.1424
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-HYDROXY-2,2-DIMETHYLBUTYRIC ACID .BETA.-LACTONE

SMILES

CC1OC(=O)C1(C)C

InChI

InChIKey=DZJYBEBRJNJOLP-UHFFFAOYSA-N
InChI=1S/C6H10O2/c1-4-6(2,3)5(7)8-4/h4H,1-3H3

HIDE SMILES / InChI

Molecular Formula C6H10O2
Molecular Weight 114.1424
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:37:44 GMT 2023
Edited
by admin
on Sat Dec 16 11:37:44 GMT 2023
Record UNII
57CE4083GX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-HYDROXY-2,2-DIMETHYLBUTYRIC ACID .BETA.-LACTONE
Common Name English
3-HYDROXY-2,2-DIMETHYLBUTYRIC ACID BETA-LACTONE
Common Name English
2-OXETANONE, 3,3,4-TRIMETHYL-
Systematic Name English
Code System Code Type Description
PUBCHEM
167725
Created by admin on Sat Dec 16 11:37:44 GMT 2023 , Edited by admin on Sat Dec 16 11:37:44 GMT 2023
PRIMARY
EPA CompTox
DTXSID40939946
Created by admin on Sat Dec 16 11:37:44 GMT 2023 , Edited by admin on Sat Dec 16 11:37:44 GMT 2023
PRIMARY
CAS
18523-58-5
Created by admin on Sat Dec 16 11:37:44 GMT 2023 , Edited by admin on Sat Dec 16 11:37:44 GMT 2023
PRIMARY
FDA UNII
57CE4083GX
Created by admin on Sat Dec 16 11:37:44 GMT 2023 , Edited by admin on Sat Dec 16 11:37:44 GMT 2023
PRIMARY