Chemical Properties of Diethylmalonic acid, butyl 2,2,3,3-tetrafluoropropyl ester

Diethylmalonic acid, butyl 2,2,3,3-tetrafluoropropyl ester

InChI
InChI=1S/C14H22F4O4/c1-4-7-8-21-11(19)13(5-2,6-3)12(20)22-9-14(17,18)10(15)16/h10H,4-9H2,1-3H3
InChI Key
AHPLTXXJXAATTK-UHFFFAOYSA-N
Formula
C14H22F4O4
SMILES
CCCCOC(=O)C(CC)(CC)C(=O)OCC(F)(F)C(F)F
Molecular Weight1
330.32
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Physical Properties

Property Value Unit Source
ΔfH°gas -1724.86 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 34.72 kJ/mol Joback Calculated Property
ΔvapH° 76.09 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 3.580 Crippen Calculated Property
McVol 230.080 ml/mol McGowan Calculated Property
Inp 1394.00 NIST
Tboil 522.06 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [364.71; 789.58] 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 A1.47160e+01
Coefficient B1.52896e+00
Coefficient C-9.61000e-04
Coefficient D2.06900e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 364.71 J/mol×K 273.00 Calculated Property
Cp,gas 444.51 J/mol×K 353.78 Calculated Property
Cp,gas 514.64 J/mol×K 434.56 Calculated Property
Cp,gas 575.74 J/mol×K 515.33 Calculated Property
Cp,gas 628.48 J/mol×K 596.11 Calculated Property
Cp,gas 673.51 J/mol×K 676.89 Calculated Property
Cp,gas 711.48 J/mol×K 757.67 Calculated Property
Cp,gas 743.04 J/mol×K 838.44 Calculated Property
Cp,gas 768.86 J/mol×K 919.22 Calculated Property
Cp,gas 789.58 J/mol×K 1000.00 Calculated Property

Similar Compounds

Diethylmalonic acid, pentyl 2,2,3,3-tetrafluoropropyl ester. Diethylmalonic acid, hexyl 2,2,3,3-tetrafluoropropyl ester. Diethylmalonic acid, octyl 2,2,3,3-tetrafluoropropyl ester. Diethylmalonic acid, heptyl 2,2,3,3-tetrafluoropropyl ester. Diethylmalonic acid, propyl 2,2,3,3-tetrafluoropropyl ester. Diethylmalonic acid, butyl 2,2,3,3,3-pentafluoropropyl ester. Diethylmalonic acid, pentyl 2,2,3,3,3-pentafluoropropyl ester. Diethylmalonic acid, isobutyl 2,2,3,3-tetrafluoropropyl ester. Diethylmalonic acid, hexyl 2,2,3,3,3-pentafluoropropyl ester. Diethylmalonic acid, 2,2,3,3,3-pentafluoropropyl undecyl ester. Diethylmalonic acid, tridecyl 2,2,3,3,3-pentafluoropropyl ester. Diethylmalonic acid, decyl 2,2,3,3,3-pentafluoropropyl ester. Diethylmalonic acid, heptyl 2,2,3,3,3-pentafluoropropyl ester. Diethylmalonic acid, hexadecyl 2,2,3,3,3-pentafluoropropyl ester. Diethylmalonic acid, 2,2,3,3,3-pentafluoropropyl tetradecyl ester.

Find more compounds similar to Diethylmalonic acid, butyl 2,2,3,3-tetrafluoropropyl ester.

Sources

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