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

Details

Stereochemistry ACHIRAL
Molecular Formula C10H18O3
Molecular Weight 186.2481
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ISOAMYL LEVULINATE

SMILES

CC(C)CCOC(=O)CCC(C)=O

InChI

InChIKey=NYIALINCMIXBSP-UHFFFAOYSA-N
InChI=1S/C10H18O3/c1-8(2)6-7-13-10(12)5-4-9(3)11/h8H,4-7H2,1-3H3

HIDE SMILES / InChI

Approval Year

Patents
Name Type Language
ISOAMYL LEVULINATE
Systematic Name English
PENTANOIC ACID, 4-OXO-, 3-METHYLBUTYL ESTER
Common Name English
LEVULINIC ACID, ISOPENTYL ESTER
Common Name English
FEMA NO. 4481
Code English
ISOPENTYL LEVULINATE
Systematic Name English
Classification Tree Code System Code
JECFA EVALUATION ISOAMYL LEVULINATE
Created by admin on Sat Dec 16 00:46:01 GMT 2023 , Edited by admin on Sat Dec 16 00:46:01 GMT 2023
Code System Code Type Description
JECFA MONOGRAPH
1950
Created by admin on Sat Dec 16 00:46:01 GMT 2023 , Edited by admin on Sat Dec 16 00:46:01 GMT 2023
PRIMARY
FDA UNII
P35CN794AQ
Created by admin on Sat Dec 16 00:46:01 GMT 2023 , Edited by admin on Sat Dec 16 00:46:01 GMT 2023
PRIMARY
PUBCHEM
522404
Created by admin on Sat Dec 16 00:46:01 GMT 2023 , Edited by admin on Sat Dec 16 00:46:01 GMT 2023
PRIMARY
CAS
71172-75-3
Created by admin on Sat Dec 16 00:46:01 GMT 2023 , Edited by admin on Sat Dec 16 00:46:01 GMT 2023
PRIMARY
EPA CompTox
DTXSID30221367
Created by admin on Sat Dec 16 00:46:01 GMT 2023 , Edited by admin on Sat Dec 16 00:46:01 GMT 2023
PRIMARY