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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 BUTYRATE

SMILES

CCCC(=O)OC(C)C

InChI

InChIKey=FFOPEPMHKILNIT-UHFFFAOYSA-N
InChI=1S/C7H14O2/c1-4-5-7(8)9-6(2)3/h6H,4-5H2,1-3H3

HIDE SMILES / InChI

Approval Year

PubMed

PubMed

TitleDatePubMed
A new potential attractant for Anastrepha obliqua from Spondias mombin fruits.
2006 Feb
Field evaluation of potential fruit-derived lures for Anastrepha obliqua (Diptera: Tephritidae).
2009 Dec
Structures and energetics of unimolecular thermal degradation of isopropyl butanoate as a model biofuel: density functional theory and ab initio studies.
2010 Aug 5
Patents
Name Type Language
ISOPROPYL BUTYRATE
FHFI  
Systematic Name English
BUTYRIC ACID, ISOPROPYL ESTER
Common Name English
1-METHYLETHYL BUTANOATE
Systematic Name English
BUTANOIC ACID, 1-METHYLETHYL ESTER
Common Name English
ISOPROPYL BUTYRATE [FHFI]
Common Name English
ISOPROPYL BUTANOATE
Systematic Name English
FEMA NO. 2935
Code English
Classification Tree Code System Code
JECFA EVALUATION ISOPROPYL BUTYRATE
Created by admin on Fri Dec 15 19:06:30 GMT 2023 , Edited by admin on Fri Dec 15 19:06:30 GMT 2023
CFR 21 CFR 172.515
Created by admin on Fri Dec 15 19:06:30 GMT 2023 , Edited by admin on Fri Dec 15 19:06:30 GMT 2023
Code System Code Type Description
PUBCHEM
61184
Created by admin on Fri Dec 15 19:06:30 GMT 2023 , Edited by admin on Fri Dec 15 19:06:30 GMT 2023
PRIMARY
EPA CompTox
DTXSID5075288
Created by admin on Fri Dec 15 19:06:30 GMT 2023 , Edited by admin on Fri Dec 15 19:06:30 GMT 2023
PRIMARY
ECHA (EC/EINECS)
211-320-7
Created by admin on Fri Dec 15 19:06:30 GMT 2023 , Edited by admin on Fri Dec 15 19:06:30 GMT 2023
PRIMARY
FDA UNII
7P33GFV8SS
Created by admin on Fri Dec 15 19:06:30 GMT 2023 , Edited by admin on Fri Dec 15 19:06:30 GMT 2023
PRIMARY
CAS
638-11-9
Created by admin on Fri Dec 15 19:06:30 GMT 2023 , Edited by admin on Fri Dec 15 19:06:30 GMT 2023
PRIMARY
JECFA MONOGRAPH
388
Created by admin on Fri Dec 15 19:06:30 GMT 2023 , Edited by admin on Fri Dec 15 19:06:30 GMT 2023
PRIMARY