Chemical Properties of Butanoic acid, 2-ethyl-3-oxo-, ethyl ester (CAS 607-97-6)

Butanoic acid, 2-ethyl-3-oxo-, ethyl ester

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InChI
InChI=1S/C8H14O3/c1-4-7(6(3)9)8(10)11-5-2/h7H,4-5H2,1-3H3
InChI Key
OKANYBNORCUPKZ-UHFFFAOYSA-N
Formula
C8H14O3
SMILES
CCOC(=O)C(CC)C(C)=O
Molecular Weight1
158.20
CAS
607-97-6
Other Names
  • 2-Ethyl-3-oxobutanoic acid ethyl ester
  • 2-Ethylacetoacetic acid ethyl ester
  • Acetoacetic acid, 2-ethyl-, ethyl ester
  • Butanoic acid, 2-ethyl-3-oxo-, ethyl ester
  • Ethyl 2-ethyl-3-ketobutyrate
  • Ethyl 2-ethylacetoacetate
  • Ethyl ethylacetoacetate
  • Ethyl «alpha»-acetylbutyrate
  • Ethyl «alpha»-ethylacetoacetate
  • NSC 53775
Sources

Physical Properties

Property Value Unit Source
Δcliquid -4432.30 ± 2.10 kJ/mol NIST
Δf -348.80 kJ/mol Joback Calculated Property
Δfgas -571.11 kJ/mol Joback Calculated Property
Δfus 17.34 kJ/mol Joback Calculated Property
Δvap 48.92 kJ/mol Joback Calculated Property
logPoct/wat 1.165 Crippen Calculated Property
Pc 2862.74 kPa Joback Calculated Property
Tboil 471.15 ± 1.00 K NIST
Tc 700.78 K Joback Calculated Property
Tfus 287.01 K Joback Calculated Property
Vc 0.507 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 298.94 J/mol×K 512.16 Joback Calculated Property
η 0.0002633 Pa×s 512.16 Joback Calculated Property
ΔvapH 53.30 kJ/mol 392.0 NIST

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 1
-CH2- 2
>C=O (nonring) 2
-CH3 3

Similar Compounds

Ethyl diacetylacetate. Butanoic acid, 2-methyl-3-oxo-, ethyl ester. Butanoic acid, 2-acetyl-3-methyl-, ethyl ester. 2(3H)-Furanone, 3-acetyldihydro-. Cyclopentanecarboxylic acid, 2-oxo-, ethyl ester. Heptanoic acid, 2-acetyl-, ethyl ester. Butanoic acid, 2,2-dimethyl-3-oxo-, ethyl ester. Hexanoic acid, 2-acetyl-5-oxo-, ethyl ester. Cyclohexanecarboxylic acid, 2-oxo-, ethyl ester. Butanoic acid, 2-methyl-3-oxo-, methyl ester. Diethyl 2-acetylglutarate. Butanedioic acid, acetyl-, diethyl ester. Propanedioic acid, acetyl-, diethyl ester. Cyclopentanecarboxylic acid, 2-oxo-, methyl ester. 2(3h)-Furanone, 3-acetyldihydro-3-methyl-.

Find more compounds similar to Butanoic acid, 2-ethyl-3-oxo-, ethyl ester.

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