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

Details

Stereochemistry ACHIRAL
Molecular Formula C7H14O2
Molecular Weight 130.1849
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ISOPROPYL ISOBUTYRATE

SMILES

CC(C)OC(=O)C(C)C

InChI

InChIKey=WVRPFQGZHKZCEB-UHFFFAOYSA-N
InChI=1S/C7H14O2/c1-5(2)7(8)9-6(3)4/h5-6H,1-4H3

HIDE SMILES / InChI

Approval Year

PubMed

PubMed

TitleDatePubMed
Name Type Language
ISOPROPYL ISOBUTYRATE
FHFI  
Systematic Name English
ISOPROPYL ISOBUTYRATE [FHFI]
Common Name English
FEMA NO. 2937
Code English
1-METHYLETHYL 2-METHYLPROPANOATE
Systematic Name English
ISOBUTYRIC ACID, ISOPROPYL ESTER
Common Name English
ISOPROPYL 2-METHYLPROPANOATE
Systematic Name English
Classification Tree Code System Code
CFR 21 CFR 172.515
Created by admin on Fri Dec 15 20:40:46 GMT 2023 , Edited by admin on Fri Dec 15 20:40:46 GMT 2023
JECFA EVALUATION ISOPROPYL ISOBUTYRATE
Created by admin on Fri Dec 15 20:40:46 GMT 2023 , Edited by admin on Fri Dec 15 20:40:46 GMT 2023
Code System Code Type Description
PUBCHEM
12044
Created by admin on Fri Dec 15 20:40:46 GMT 2023 , Edited by admin on Fri Dec 15 20:40:46 GMT 2023
PRIMARY
FDA UNII
IB2671N3UT
Created by admin on Fri Dec 15 20:40:46 GMT 2023 , Edited by admin on Fri Dec 15 20:40:46 GMT 2023
PRIMARY
JECFA MONOGRAPH
390
Created by admin on Fri Dec 15 20:40:46 GMT 2023 , Edited by admin on Fri Dec 15 20:40:46 GMT 2023
PRIMARY
ECHA (EC/EINECS)
210-517-5
Created by admin on Fri Dec 15 20:40:46 GMT 2023 , Edited by admin on Fri Dec 15 20:40:46 GMT 2023
PRIMARY
RXCUI
1429933
Created by admin on Fri Dec 15 20:40:46 GMT 2023 , Edited by admin on Fri Dec 15 20:40:46 GMT 2023
PRIMARY RxNorm
EPA CompTox
DTXSID10862297
Created by admin on Fri Dec 15 20:40:46 GMT 2023 , Edited by admin on Fri Dec 15 20:40:46 GMT 2023
PRIMARY
CAS
617-50-5
Created by admin on Fri Dec 15 20:40:46 GMT 2023 , Edited by admin on Fri Dec 15 20:40:46 GMT 2023
PRIMARY