Chemical Properties of 1,3-Dioxolane-2-acetic acid, 2,4-dimethyl-, ethyl ester (CAS 6290-17-1)

1,3-Dioxolane-2-acetic acid, 2,4-dimethyl-, ethyl ester

InChI
InChI=1S/C9H16O4/c1-3-11-8(10)7-9(2)12-5-4-6-13-9/h3-7H2,1-2H3
InChI Key
XMLLBDKQPQZGDP-UHFFFAOYSA-N
Formula
C9H16O4
SMILES
CCOC(=O)CC1(C)OCCCO1
Molecular Weight1
188.22
CAS
6290-17-1
Other Names
  • Acetoacetic acid, ethyl ester, 1,2-propylene ketal
  • Ethyl 2,4-dimethyl-1,3-dioxolane-2-acetate
  • Ethylacetoacetate propyleneglycol ketal
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Physical Properties

Property Value Unit Source
ω 0.4814 Relay (1.0) Calculated Property
ΔfG° -438.75 kJ/mol Joback Calculated Property
ΔfH°gas -820.00 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 24.93 kJ/mol Joback Calculated Property
ΔvapH° 65.41 kJ/mol Relay (1.0) Calculated Property
IE 9.56 eV Relay (1.0) Calculated Property
log10WS -0.65 Relay (1.0) Calculated Property
logPoct/wat 1.093 Crippen Calculated Property
McVol 145.990 ml/mol McGowan Calculated Property
Pc 2937.70 kPa Joback Calculated Property
Tboil 481.46 K Relay (1.0) Calculated Property
Tc 684.30 K Relay (1.0) Calculated Property
Tfus 235.18 K Relay (1.0) Calculated Property
Vc 0.555 m3/kmol Relay (1.0) Calculated Property

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [205.42; 523.20] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-6.08380e+01
Coefficient B1.21204e+00
Coefficient C-9.57000e-04
Coefficient D3.29000e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 205.42 J/mol×K 273.00 Calculated Property
Cp,gas 262.75 J/mol×K 353.78 Calculated Property
Cp,gas 312.14 J/mol×K 434.56 Calculated Property
Cp,gas 354.64 J/mol×K 515.33 Calculated Property
Cp,gas 391.30 J/mol×K 596.11 Calculated Property
Cp,gas 423.14 J/mol×K 676.89 Calculated Property
Cp,gas 451.21 J/mol×K 757.67 Calculated Property
Cp,gas 476.55 J/mol×K 838.44 Calculated Property
Cp,gas 500.20 J/mol×K 919.22 Calculated Property
Cp,gas 523.20 J/mol×K 1000.00 Calculated Property

Similar Compounds

1,3-DIOXOLANE-2-ACETIC ACID, 2-METHYL-, ETHYL ESTER. 1,3-Dioxolane-2-ethanol, 2-methyl-, acetate. Diethylmalonic acid, di(2-(3,3-dimethyl-2,4-oxacyclopentyl)ethyl) ester. Diethylmalonic acid, 2-(3,3-dimethyl-2,4-oxacyclopentyl)ethyl ethyl ester. 1,1,3-Triethoxybutane. 4-(2-Hydroxyethyl)-2,2-dimethyl-1,3-dioxolane, chlorodifluoroacetate. Levulinic acid, ethyl ester, diethyl acetal. Methyl 2-(2,2-dimethyl-1,3-dioxolan-4-yl)-2-(ethoxycarbonyloxy)acetate. 1,3-Dioxane, 2-ethyl-2methyl-4-pentyl, 2R,4R. 1,3-Dioxane, 2-ethyl-2-methyl-4-pentyl, 2S,4R. Butanoic acid, 3-(1-ethoxyethoxy)-2-methyl-, ethyl ester. Diethylmalonic acid, monochloride, 2-(3,3-dimethyl-2,4-oxacyclopentyl)ethyl ester. 1,3-Dioxolane-2-propanoic acid, 2-methyl-, ethyl ester. Methyl (4S,5R)-2,2,5-trimethyl-1,3-dioxolane-4-carboxylate. Furan, tetrahydro, 2-ethoxy-2-methyl.

Find more compounds similar to 1,3-Dioxolane-2-acetic acid, 2,4-dimethyl-, ethyl ester.

Sources

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