Diethyl 1,3-acetonedicarboxylate

Diethyl 1,3-acetonedicarboxylate Basic information
Product Name:Diethyl 1,3-acetonedicarboxylate
Synonyms:Diethyl 1,3-acetonedicarboxylate ,94%;Diethyl 1,3-acetonedicarboxylate ,96%;Diethyl 1,3-acetonedicarboxylate,Diethyl 3-oxoglutarate;Diethyl-3-oxo-pentan;Diethyl β-ketoglutarate;Diethyl 3-oxopentane-1,5-dioate, Diethyl acetone-1,3-dicarboxylate;Diethyl 1,3-acetonedicarboxylate, 95% 50ML;3-Oxopentanedioic acid, diethyl ester
CAS:105-50-0
MF:C9H14O5
MW:202.2
EINECS:203-302-2
Product Categories:Building Blocks;C8 to C9;Carbonyl Compounds;Chemical Synthesis;Esters;Organic Building Blocks;Pharmaceutical Intermediates;straight chain compounds;API intermediates;API;bc0001
Mol File:105-50-0.mol
Diethyl 1,3-acetonedicarboxylate Structure
Diethyl 1,3-acetonedicarboxylate Chemical Properties
Melting point 125 °C
Boiling point 250 °C (lit.)
density 1.113 g/mL at 25 °C (lit.)
refractive index n20/D 1.440(lit.)
Fp 187 °F
storage temp. Sealed in dry,2-8°C
solubility Chloroform (Slightly), Ethyl Acetate (Slightly)
pka9.66±0.46(Predicted)
form Liquid
color Clear colorless to pale yellow
Water Solubility 10 g/L (20 ºC)
Sensitive Moisture Sensitive
BRN 640146
InChIKeyZSANYRMTSBBUCA-UHFFFAOYSA-N
CAS DataBase Reference105-50-0(CAS DataBase Reference)
NIST Chemistry ReferencePentanedioic acid, 3-oxo-, diethyl ester(105-50-0)
EPA Substance Registry SystemPentanedioic acid, 3-oxo-, diethyl ester (105-50-0)
Safety Information
Hazard Codes F,Xi
Risk Statements 36/37/38
Safety Statements 23-24/25-36-26
RIDADR UN 2810
WGK Germany 3
Hazard Note Flammable/Moisture Sensitive
TSCA Yes
HS Code 29183000
MSDS Information
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Diethyl 1,3-acetonedicarboxylate English
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Diethyl 1,3-acetonedicarboxylate Usage And Synthesis
Chemical Propertiesclear colorless to pale yellow liquid
UsesDiethyl 1,3-acetonedicarboxylate was used in the synthesis of novel pyrido[4,3,2-de]quinoline, isoquinolino[6,5,4,3-cde] quinoline and pyrazomycin. It was used as starting reagent in the synthesis of (±)-thienamycin, potent β-lactam antibiotic.
DIBENZYL ACETONE DICARBOXYLATE 2-Ketoglutaric acid Ethyl 2,4-dioxovalerate Ethyl pyruvate ACETONEDICARBOXYLIC ACID, DI-N-PROPYL ESTER ACETONEDICARBOXYLIC ACID, DI-N-OCTYL ESTER Diethyl azodicarboxylate Diethyl ether Dimethyl Glutarate Diethyl phosphite SALOR-INT L161136-1EA DI-N-AMYL ACETONE DICARBOXYLATE DI-N-HEXYL ACETONE DICARBOXYLATE Glutaric acid Diethyl malonate Phenoxyethyl isobutyrate DI-TERT-BUTYL 1,3-ACETONEDICARBOXYLATE ACETONEDICARBOXYLIC ACID, DI-N-DODECYL ESTER

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