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Details

Stereochemistry ACHIRAL
Molecular Formula C5H10O2
Molecular Weight 102.1317
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYL ISOBUTYRATE

SMILES

COC(=O)C(C)C

InChI

InChIKey=BHIWKHZACMWKOJ-UHFFFAOYSA-N
InChI=1S/C5H10O2/c1-4(2)5(6)7-3/h4H,1-3H3

HIDE SMILES / InChI

Approval Year

PubMed

PubMed

TitleDatePubMed
Magnetic anisotropy of the antiferromagnetic ring [Cr8F8Piv16].
2002 Jan 4
Enantioselective catalysis in water: Mukaiyama-aldol condensation promoted by copper complexes of bisoxazolines supported on poly(ethylene glycol).
2004 Nov 21
Laser flash photolysis and CIDNP studies of steric effects on coupling rate constants of imidazolidine nitroxide with carbon-centered radicals, methyl isobutyrate-2-yl and tert-butyl propionate-2-yl.
2006 Aug 4
Patents
Name Type Language
METHYL ISOBUTYRATE
FCC   FHFI   MI  
Systematic Name English
FEMA NO. 2694
Code English
METHYL ISOBUTYRATE [FCC]
Common Name English
METHYL ISOBUTYRATE [MI]
Common Name English
METHYL ISOBUTYRATE [FHFI]
Common Name English
METHYL 2-METHYLPROPIONATE
Systematic Name English
PROPANOIC ACID, 2-METHYL-, METHYL ESTER
Common Name English
ISOBUTYRIC ACID, METHYL ESTER
Common Name English
NSC-126780
Code English
Classification Tree Code System Code
JECFA EVALUATION METHYL ISOBUTYRATE
Created by admin on Fri Dec 15 17:44:34 GMT 2023 , Edited by admin on Fri Dec 15 17:44:34 GMT 2023
CFR 21 CFR 172.515
Created by admin on Fri Dec 15 17:44:34 GMT 2023 , Edited by admin on Fri Dec 15 17:44:34 GMT 2023
Code System Code Type Description
WIKIPEDIA
Methyl isobutyrate
Created by admin on Fri Dec 15 17:44:34 GMT 2023 , Edited by admin on Fri Dec 15 17:44:34 GMT 2023
PRIMARY
JECFA MONOGRAPH
212
Created by admin on Fri Dec 15 17:44:34 GMT 2023 , Edited by admin on Fri Dec 15 17:44:34 GMT 2023
PRIMARY
EVMPD
SUB90715
Created by admin on Fri Dec 15 17:44:34 GMT 2023 , Edited by admin on Fri Dec 15 17:44:34 GMT 2023
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MERCK INDEX
m7430
Created by admin on Fri Dec 15 17:44:34 GMT 2023 , Edited by admin on Fri Dec 15 17:44:34 GMT 2023
PRIMARY Merck Index
RXCUI
2460732
Created by admin on Fri Dec 15 17:44:34 GMT 2023 , Edited by admin on Fri Dec 15 17:44:34 GMT 2023
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SMS_ID
100000141051
Created by admin on Fri Dec 15 17:44:34 GMT 2023 , Edited by admin on Fri Dec 15 17:44:34 GMT 2023
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ECHA (EC/EINECS)
208-929-5
Created by admin on Fri Dec 15 17:44:34 GMT 2023 , Edited by admin on Fri Dec 15 17:44:34 GMT 2023
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PUBCHEM
11039
Created by admin on Fri Dec 15 17:44:34 GMT 2023 , Edited by admin on Fri Dec 15 17:44:34 GMT 2023
PRIMARY
CAS
547-63-7
Created by admin on Fri Dec 15 17:44:34 GMT 2023 , Edited by admin on Fri Dec 15 17:44:34 GMT 2023
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NSC
126780
Created by admin on Fri Dec 15 17:44:34 GMT 2023 , Edited by admin on Fri Dec 15 17:44:34 GMT 2023
PRIMARY
FDA UNII
EM286QL922
Created by admin on Fri Dec 15 17:44:34 GMT 2023 , Edited by admin on Fri Dec 15 17:44:34 GMT 2023
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EPA CompTox
DTXSID5060275
Created by admin on Fri Dec 15 17:44:34 GMT 2023 , Edited by admin on Fri Dec 15 17:44:34 GMT 2023
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