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diethyl acetylpropanedioate

Acetonedicarboxylic Acid Diethyl Ester

CAS: 105-50-0

Molecular Formula: C9H14O5

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diethyl acetylpropanedioate - Names and Identifiers

Name Acetonedicarboxylic Acid Diethyl Ester
Synonyms Diethyl-3-oxo-pentan
Diethyl 3-Oxoglutarate
Diethyl β-ketoglutarate
Diethyl 3-oxopentanedioate
diethyl acetylpropanedioate
Diethyl acetonedicarboxylate
Diethyl-3-oxo-pentanedionate
Diethylacetone dicarboxylate
Diethyl1,3-Acetonedicarboxylate
Diethyl 1,3-Acetonedicarboxylate
Diethyl 1,3-acetonedicarboxylate
Diethyl-1,3-acetonedicarboxylate
Diethyl-1,3-Acetonedicarboxyalte
Diethyl acetone-1,3-dicarboxylate
Diethyl 1,3-acetone dicarboxylate
3-oxo-pentanedioicacidiethyl ester
3-oxo-pentanedioic aci diethyl ester
3-Oxopentanedioic acid, diethyl ester
Acetonedicarboxylic Acid Diethyl Ester
1,3-Acetonedicarboxylic Acid Diethyl Ester
Acetone-1,3-dicarboxylic acid diethyl ester
Diethyl 1,3-acetonedicarboxylate,Diethyl 3-oxoglutarate
1,3-Acetonedicarboxylicaciddiethylester Diethyl3-oxoglutarate
Diethyl 3-oxopentane-1,5-dioate, Diethyl acetone-1,3-dicarboxylate
CAS 105-50-0
EINECS 203-302-2
InChI InChI=1/C9H14O5/c1-4-13-8(11)7(6(3)10)9(12)14-5-2/h7H,4-5H2,1-3H3
InChIKey ZSANYRMTSBBUCA-UHFFFAOYSA-N

diethyl acetylpropanedioate - Physico-chemical Properties

Molecular FormulaC9H14O5
Molar Mass202.2
Density1.113 g/mL at 25 °C (lit.)
Melting Point125 °C
Boling Point250 °C (lit.)
Flash Point187°F
Water Solubility10 g/L (20 ºC)
Vapor Presure0.0605mmHg at 25°C
AppearanceLiquid
ColorClear colorless to pale yellow
BRN640146
pKa9.66±0.46(Predicted)
Storage ConditionSealed in dry,2-8°C
SensitiveMoisture Sensitive
Refractive Indexn20/D 1.440(lit.)
Physical and Chemical Properties

Boiling Point: 250 ℃
flash point: 86 ℃
density: 1.113
solubility: insoluble in water, soluble in alcohol, ether, benzene.
storage conditions: 2-8°C

UseFor organic synthesis; Pharmaceutical intermediates

diethyl acetylpropanedioate - Risk and Safety

Risk Codes36/37/38 - Irritating to eyes, respiratory system and skin.
Safety DescriptionS23 - Do not breathe vapour.
S24/25 - Avoid contact with skin and eyes.
S36 - Wear suitable protective clothing.
S26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
UN IDsUN 2810
WGK Germany3
TSCAYes
HS Code29183000
Hazard NoteFlammable/Moisture Sensitive

diethyl acetylpropanedioate - Reference Information

NIST chemical information information provided by: webbook.nist.gov (external link)
EPA chemical substance information information provided by: ofmpeb.epa.gov (external link)
Use organic synthesis intermediates.
used in organic synthesis
organic synthesis, pharmaceutical synthesis intermediates, can be used for the synthesis of strontium ranelate.
production method is obtained by reacting 1, 3-propanediecarboxylic acid with absolute ethanol.
Last Update:2024-04-10 22:29:15
diethyl acetylpropanedioate
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diethyl acetylpropanedioate
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