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Details

Stereochemistry ACHIRAL
Molecular Formula C7H12O4
Molecular Weight 160.1678
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIETHYL MALONATE

SMILES

CCOC(=O)CC(=O)OCC

InChI

InChIKey=IYXGSMUGOJNHAZ-UHFFFAOYSA-N
InChI=1S/C7H12O4/c1-3-10-6(8)5-7(9)11-4-2/h3-5H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C7H12O4
Molecular Weight 160.1678
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Sourcing

Sourcing

Vendor/AggregatorIDURL
PubMed

PubMed

TitleDatePubMed
[Potential antimitotics. 2. Synthesis of 1-benzyl-3-carbethoxy-2-quinolones].
2002
Carbon nucleophiles in the Mitsunobu reaction. Mono- and dialkylation of bis(2,2,2-trifluoroethyl) malonates.
2002 Oct 31
Synthesis and cytotoxicity evaluation of 2-amino- and 2-hidroxy-3-ethoxycarbonyl-N-substituted-benzo[f]indole-4,9-dione derivatives.
2003 Apr 3
Novel autoxidation and Michael addition of a butenolide-containing sugar leading to a C-branched-chain glucopyranosidulose, and X-ray structure of intermediates.
2003 Aug 12
Bromination by means of sodium monobromoisocyanurate (SMBI).
2003 Jul 21
Synthesis of 5-substituted 2-methylbenzimidazoles with anticancer activity.
2003 Mar
The Michael reaction catalyzed by KF/basic alumina under ultrasound irradiation.
2003 Mar
Synthesis of a novel conformationally locked carbocyclic nucleoside ring system.
2003 May 15
Electrophilicity parameters for benzylidenemalononitriles.
2003 Sep 5
Solvent-free reactions of C60 with active methylene compounds, either with or without carbon tetrabromide, in the presence of bases under high-speed vibration milling conditions.
2004 Jun 21
Experimental and theoretical analysis of the photochemistry and thermal reactivity of ethyl diazomalonate and its diazirino isomer. The role of molecular geometry in the decomposition of diazocarbonyl compounds.
2004 Sep 15
Importance of chiral phase-transfer catalysts with dual functions in obtaining high enantioselectivity in the Michael reaction of malonates and chalcone derivatives.
2005 Jul 21
Regioselective single and double conjugate additions to substituted cyclohexa-2,5-dienone monoacetals.
2005 Jul 21
Parallel liquid-phase synthesis of N-substituted 6-aminosulfonyl-2-oxo-1,2-dihydroquinoline-4-carboxamide and 6-aminosulfonylquinoline-4-carboxamide derivatives.
2005 Mar-Apr
CuI/L-proline-catalyzed coupling reactions of aryl halides with activated methylene compounds.
2005 Oct 13
Synthesis of new amphiphilic dendrons bearing aliphatic hydrocarbon surface sectors and a monocarboxylic or dicarboxylic acid focal point.
2006 Feb 2
NMR spectroscopy and MALDI-TOF MS characterisation of end-functionalised PVP oligomers prepared with different esters as chain transfer agents.
2006 Mar 14
Synthesis of 7-oxo-7H-naphtho[1,2,3-de]quinoline derivatives as potential anticancer agents active on multidrug resistant cell lines.
2006 May 1
Room-temperature copper-catalyzed alpha-arylation of malonates.
2007 Aug 16
Manganese(III)-catalyzed free radical reactions on trimetallic nitride endohedral metallofullerenes.
2007 Dec 19
The decarboxylative Blaise reaction.
2007 Dec 21
Ring expansion reactions of 4-amino-1,1-dioxo-[1,2,3,5]-thiatriazoles.
2007 Feb 7
Tandem Knoevenagel-Michael addition of aryl sulfonimines with diethyl malonate for synthesis of arylidene dimalonates.
2007 Jul 20
Reaction of perfluorocyclopentene with various carbon nucleophiles--heteroaromatic lithium reagents, enolate and phosphonium ylide.
2007 May 7
Diethyl 2-(triphenyl-meth-yl)malonate.
2008
4,4-Diacetyl-hepta-nedinitrile.
2008 Dec 3
Performance of SM8 on a test to predict small-molecule solvation free energies.
2008 Jul 24
Convenient synthesis of ethyl 4-aryl-6-(trifluoromethyl)-2-oxo-2H-pyran-3-carboxylates and 4-aryl-6-(trifluoromethyl)-2H-pyran-2-ones: novel highly reactive CF3-containing building blocks.
2008 Jul 3
Chiral enhancement in diethyl malonate addition by morphosynthesized L-proline mesoporous silica.
2008 May 7
Allopregnanolone (3alpha-hydroxy-5alpha-pregnan-20-one) derivatives with a polar chain in position 16alpha: synthesis and activity.
2009 Apr 9
Diethyl 2-(2-nitro-benzyl-idene)malonate.
2009 Aug 22
(Cyclo-pentane-1,1-di-yl)dimethanol.
2009 Feb 6
Monomeric malonate precursors for the MOCVD of HfO2 and ZrO2 thin films.
2009 Jan 28
Dimethyl 4,4-diacetyl-hepta-nedioate.
2009 Jan 8
Synthetic studies in butenonyl C-glycosides: Preparation of polyfunctional alkanonyl glycosides and their enzyme inhibitory activity.
2009 May 15
Condensation of beta-diester titanium enolates with carbonyl substrates: a combined DFT and experimental investigation.
2009 Nov 2
A facile synthesis of dispersable NaCl nanocrystals.
2009 Nov 28
Ethyl 6-chloro-2-oxo-4-phenyl-1,2-dihydro-quinoline-3-carboxyl-ate.
2009 Nov 4
Tetramic and tetronic acids as scaffolds in bioinorganic and bioorganic chemistry.
2010
Novel synthesis of methyl 4,6-O-benzylidenespiro[2-deoxy-alpha-D-arabino-hexopyranoside-2,2'-imidazolidine] and its homologue and sugar-gamma-butyrolactam derivatives from methyl 4,6-O-benzylidene-alpha-D-arabino-hexopyranosid-2-ulose.
2010 Apr 19
Aliphatic hyperbranched polyester: a new building block in the construction of multifunctional nanoparticles and nanocomposites.
2010 Apr 20
(-)-(1S,5R)-2-Oxabicyclo-[3.3.1]nonan-3-one.
2010 Apr 24
Synthesis and anti-HIV evaluation of new acyclic phosphonate nucleotide analogues and their bis(SATE) derivatives.
2010 Aug
Synthesis of asymmetric peroxides: transition metal (Cu, Fe, Mn, Co) catalyzed peroxidation of beta-dicarbonyl compounds with tert-butyl hydroperoxide.
2010 Aug 6
1-[(E)-4-(5-Bromo-1H-indol-3-yl)-1-methyl-2,5,6,7-tetra-hydro-1H-azepin-2-yl-idene]propan-2-one.
2010 Jun 5
Diethyl 2-{(dibenzyl-amino)[4-(trifluoro-meth-yl)phen-yl]meth-yl}malonate.
2010 Mar 27
Spectroscopic, solvent influence and thermal studies of ternary copper(II) complexes of diester and dinitrogen base ligands.
2010 Oct 15
Rapid synthesis of flavor compound 4-ethyloctanoic acid under microwave irradiation.
2010 Oct 25
Ethyl 3-oxo-3H-benzo[f]chromene-2-carboxyl-ate.
2010 Sep 30
Sensitive DsRed fluorescence-based reporter cell systems for genotoxicity and oxidative stress assessment.
2011 May 10
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:24:19 GMT 2023
Edited
by admin
on Fri Dec 15 15:24:19 GMT 2023
Record UNII
53A58PA183
Record Status Validated (UNII)
Record Version
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Name Type Language
DIETHYL MALONATE
FCC   FHFI   INCI  
INCI  
Official Name English
DIETHYL MALONATE [FHFI]
Common Name English
NSC-8864
Code English
ETHYL MALONATE [MI]
Common Name English
DEM
Common Name English
NSC-136903
Code English
FEMA NO. 2375
Code English
MALONIC ACID, DIETHYL ESTER
Common Name English
DIETHYL PROPANEDIOATE
Systematic Name English
DIETHYL MALONATE [INCI]
Common Name English
ETHYL MALONATE
MI  
Systematic Name English
DIETHYL MALONATE [FCC]
Common Name English
PROPANEDIOIC ACID, DIETHYL ESTER
Common Name English
CARBETHOXYACETIC ESTER
Common Name English
Classification Tree Code System Code
JECFA EVALUATION DIETHYL MALONATE
Created by admin on Fri Dec 15 15:24:19 GMT 2023 , Edited by admin on Fri Dec 15 15:24:19 GMT 2023
CFR 21 CFR 172.515
Created by admin on Fri Dec 15 15:24:19 GMT 2023 , Edited by admin on Fri Dec 15 15:24:19 GMT 2023
Code System Code Type Description
MESH
C498810
Created by admin on Fri Dec 15 15:24:19 GMT 2023 , Edited by admin on Fri Dec 15 15:24:19 GMT 2023
PRIMARY
NSC
136903
Created by admin on Fri Dec 15 15:24:19 GMT 2023 , Edited by admin on Fri Dec 15 15:24:19 GMT 2023
PRIMARY
CAS
105-53-3
Created by admin on Fri Dec 15 15:24:19 GMT 2023 , Edited by admin on Fri Dec 15 15:24:19 GMT 2023
PRIMARY
PUBCHEM
7761
Created by admin on Fri Dec 15 15:24:19 GMT 2023 , Edited by admin on Fri Dec 15 15:24:19 GMT 2023
PRIMARY
EVMPD
SUB91406
Created by admin on Fri Dec 15 15:24:19 GMT 2023 , Edited by admin on Fri Dec 15 15:24:19 GMT 2023
PRIMARY
EPA CompTox
DTXSID7021863
Created by admin on Fri Dec 15 15:24:19 GMT 2023 , Edited by admin on Fri Dec 15 15:24:19 GMT 2023
PRIMARY
FDA UNII
53A58PA183
Created by admin on Fri Dec 15 15:24:19 GMT 2023 , Edited by admin on Fri Dec 15 15:24:19 GMT 2023
PRIMARY
ECHA (EC/EINECS)
203-305-9
Created by admin on Fri Dec 15 15:24:19 GMT 2023 , Edited by admin on Fri Dec 15 15:24:19 GMT 2023
PRIMARY
MERCK INDEX
m5148
Created by admin on Fri Dec 15 15:24:19 GMT 2023 , Edited by admin on Fri Dec 15 15:24:19 GMT 2023
PRIMARY Merck Index
DAILYMED
53A58PA183
Created by admin on Fri Dec 15 15:24:19 GMT 2023 , Edited by admin on Fri Dec 15 15:24:19 GMT 2023
PRIMARY
WIKIPEDIA
DIETHYL MALONATE
Created by admin on Fri Dec 15 15:24:19 GMT 2023 , Edited by admin on Fri Dec 15 15:24:19 GMT 2023
PRIMARY
JECFA MONOGRAPH
1113
Created by admin on Fri Dec 15 15:24:19 GMT 2023 , Edited by admin on Fri Dec 15 15:24:19 GMT 2023
PRIMARY
EVMPD
SUB170052
Created by admin on Fri Dec 15 15:24:19 GMT 2023 , Edited by admin on Fri Dec 15 15:24:19 GMT 2023
PRIMARY
RXCUI
2395765
Created by admin on Fri Dec 15 15:24:19 GMT 2023 , Edited by admin on Fri Dec 15 15:24:19 GMT 2023
PRIMARY
SMS_ID
100000159677
Created by admin on Fri Dec 15 15:24:19 GMT 2023 , Edited by admin on Fri Dec 15 15:24:19 GMT 2023
PRIMARY
NSC
8864
Created by admin on Fri Dec 15 15:24:19 GMT 2023 , Edited by admin on Fri Dec 15 15:24:19 GMT 2023
PRIMARY