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

Details

Stereochemistry ACHIRAL
Molecular Formula C6H12O2
Molecular Weight 116.1583
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETHYL ISOBUTYRATE

SMILES

CCOC(=O)C(C)C

InChI

InChIKey=WDAXFOBOLVPGLV-UHFFFAOYSA-N
InChI=1S/C6H12O2/c1-4-8-6(7)5(2)3/h5H,4H2,1-3H3

HIDE SMILES / InChI

Approval Year

PubMed

PubMed

TitleDatePubMed
Correlating volatile compounds, sensory attributes, and quality parameters in stored fresh-cut cantaloupe.
2007 Nov 14
Nitrogen addition influences formation of aroma compounds, volatile acidity and ethanol in nitrogen deficient media fermented by Saccharomyces cerevisiae wine strains.
2009 Aug
Identification of odor impact compounds of Tagetes minuta L. essential oil: comparison of two GC-olfactometry methods.
2009 Sep 23
Volatile profiling reveals intracellular metabolic changes in Aspergillus parasiticus: veA regulates branched chain amino acid and ethanol metabolism.
2010 Aug 24
Patents
Name Type Language
ETHYL ISOBUTYRATE
FCC   FHFI   MI  
Systematic Name English
ETHYL ISOBUTYRATE [MI]
Common Name English
ETHYL ISOBUTYRATE [FHFI]
Common Name English
ISO BUTYRIC ACID ETHYL ESTER
Systematic Name English
FEMA NO. 2428
Code English
ETHYL 2-METHYLPROPANOATE
Systematic Name English
PROPANOIC ACID, 2-METHYL-, ETHYL ESTER
Common Name English
NSC-97194
Code English
ETHYL ISOBUTYRATE [FCC]
Common Name English
Classification Tree Code System Code
JECFA EVALUATION ETHYL ISOBUTYRATE
Created by admin on Fri Dec 15 17:36:42 GMT 2023 , Edited by admin on Fri Dec 15 17:36:42 GMT 2023
CFR 21 CFR 172.515
Created by admin on Fri Dec 15 17:36:42 GMT 2023 , Edited by admin on Fri Dec 15 17:36:42 GMT 2023
Code System Code Type Description
PUBCHEM
7342
Created by admin on Fri Dec 15 17:36:42 GMT 2023 , Edited by admin on Fri Dec 15 17:36:42 GMT 2023
PRIMARY
CHEBI
87303
Created by admin on Fri Dec 15 17:36:42 GMT 2023 , Edited by admin on Fri Dec 15 17:36:42 GMT 2023
PRIMARY
MESH
C546702
Created by admin on Fri Dec 15 17:36:42 GMT 2023 , Edited by admin on Fri Dec 15 17:36:42 GMT 2023
PRIMARY
JECFA MONOGRAPH
214
Created by admin on Fri Dec 15 17:36:42 GMT 2023 , Edited by admin on Fri Dec 15 17:36:42 GMT 2023
PRIMARY
EVMPD
SUB91404
Created by admin on Fri Dec 15 17:36:42 GMT 2023 , Edited by admin on Fri Dec 15 17:36:42 GMT 2023
PRIMARY
FDA UNII
9A9661LN4H
Created by admin on Fri Dec 15 17:36:42 GMT 2023 , Edited by admin on Fri Dec 15 17:36:42 GMT 2023
PRIMARY
ECHA (EC/EINECS)
202-595-4
Created by admin on Fri Dec 15 17:36:42 GMT 2023 , Edited by admin on Fri Dec 15 17:36:42 GMT 2023
PRIMARY
MERCK INDEX
m5139
Created by admin on Fri Dec 15 17:36:42 GMT 2023 , Edited by admin on Fri Dec 15 17:36:42 GMT 2023
PRIMARY Merck Index
EPA CompTox
DTXSID7047728
Created by admin on Fri Dec 15 17:36:42 GMT 2023 , Edited by admin on Fri Dec 15 17:36:42 GMT 2023
PRIMARY
CAS
97-62-1
Created by admin on Fri Dec 15 17:36:42 GMT 2023 , Edited by admin on Fri Dec 15 17:36:42 GMT 2023
PRIMARY
SMS_ID
100000141276
Created by admin on Fri Dec 15 17:36:42 GMT 2023 , Edited by admin on Fri Dec 15 17:36:42 GMT 2023
PRIMARY
NSC
97194
Created by admin on Fri Dec 15 17:36:42 GMT 2023 , Edited by admin on Fri Dec 15 17:36:42 GMT 2023
PRIMARY