Chemical Properties of 1,3-Dioxolane-2-propanoic acid, 2-methyl-, ethyl ester

1,3-Dioxolane-2-propanoic acid, 2-methyl-, ethyl ester

InChI
InChI=1S/C9H16O4/c1-3-11-8(10)4-5-9(2)12-6-7-13-9/h3-7H2,1-2H3
InChI Key
PLUNGZQWVYCJBJ-UHFFFAOYSA-N
Formula
C9H16O4
SMILES
CCOC(=O)CCC1(C)OCCO1
Molecular Weight1
188.22
Other Names
  • 1,3-Dioxolane-2-propionic acid, 2-methyl-, ethyl ester
  • 2-Propionic acid, 2-methyl-1,3-dioxolane-, ethyl ester
  • ethyl 2-methyl-1,3-dioxolane-2-propionate
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Physical Properties

Property Value Unit Source
ω 0.5196 Relay (1.0) Calculated Property
ΔfG° -426.65 kJ/mol Joback Calculated Property
ΔfH°gas -801.19 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 27.03 kJ/mol Joback Calculated Property
ΔvapH° 64.89 kJ/mol Relay (1.0) Calculated Property
IE 9.46 eV Relay (1.0) Calculated Property
log10WS -0.66 Relay (1.0) Calculated Property
logPoct/wat 1.093 Crippen Calculated Property
McVol 145.990 ml/mol McGowan Calculated Property
Pc 2859.68 kPa Joback Calculated Property
Tboil 494.69 K Relay (1.0) Calculated Property
Tc 682.39 K Relay (1.0) Calculated Property
Tfus 244.17 K Relay (1.0) Calculated Property
Vc 0.567 m3/kmol Relay (1.0) Calculated Property

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [210.31; 521.42] 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-5.57170e+01
Coefficient B1.22164e+00
Coefficient C-1.00340e-03
Coefficient D3.58900e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 210.31 J/mol×K 273.00 Calculated Property
Cp,gas 266.78 J/mol×K 353.78 Calculated Property
Cp,gas 315.12 J/mol×K 434.56 Calculated Property
Cp,gas 356.48 J/mol×K 515.33 Calculated Property
Cp,gas 391.98 J/mol×K 596.11 Calculated Property
Cp,gas 422.77 J/mol×K 676.89 Calculated Property
Cp,gas 449.97 J/mol×K 757.67 Calculated Property
Cp,gas 474.72 J/mol×K 838.44 Calculated Property
Cp,gas 498.16 J/mol×K 919.22 Calculated Property
Cp,gas 521.42 J/mol×K 1000.00 Calculated Property

Similar Compounds

1,3-Dioxolane-2-propanoic acid, 2-methyl-, methyl ester. Levulinic acid, ethyl ester, diethyl acetal. 1,3-Dioxolane, 2-methyl-2-propyl-. 4,4-ETHYLENEDIOXY-PENTANENITRILE. 1,4-CYCLOHEXANEDIONE BIS(ETHYLENE KETAL). 1,3-Dioxolane, 2-(3-chloropropyl)-2-methyl-. 1,3-Dioxolane, 2-methyl-2-pentyl-. Cyclopentanone ethylene ketal. Furan, tetrahydro, 2-ethoxy-2-methyl. 1,4-Dioxaspiro[4.5]decane. 1,3-Dioxolane-2-ethanol, 2-methyl-, acetate. Tetrahydrofuran, 2-methyl-2-methoxy. 1,3-Dioxolane, 2-methyl-2-(2-methylpropyl)-. Cyclohexanone-1,3-butanediol ketal. ethyl 4-acetoxypentanoate.

Find more compounds similar to 1,3-Dioxolane-2-propanoic acid, 2-methyl-, ethyl ester.

Sources

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