Chemical Properties of Diethylmalonic acid, 2,2,3,3,4,4,4-heptafluorobutyl propyl ester

Diethylmalonic acid, 2,2,3,3,4,4,4-heptafluorobutyl propyl ester

InChI
InChI=1S/C14H19F7O4/c1-4-7-24-9(22)11(5-2,6-3)10(23)25-8-12(15,16)13(17,18)14(19,20)21/h4-8H2,1-3H3
InChI Key
JTQWDBBWAQXEMN-UHFFFAOYSA-N
Formula
C14H19F7O4
SMILES
CCCOC(=O)C(CC)(CC)C(=O)OCC(F)(F)C(F)(F)C(F)(F)F
Molecular Weight1
384.29
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Physical Properties

Property Value Unit Source
ΔfH°gas -2363.96 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 32.66 kJ/mol Joback Calculated Property
ΔvapH° 71.78 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 4.122 Crippen Calculated Property
McVol 235.390 ml/mol McGowan Calculated Property
Inp [1294.00; 1294.00]   Show Hide
Inp 1294.00 NIST
Inp 1294.00 NIST
Tboil 501.06 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 [386.70; 813.19] 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-1.42750e+01
Coefficient B1.81006e+00
Coefficient C-1.35060e-03
Coefficient D3.68000e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 386.70 J/mol×K 273.00 Calculated Property
Cp,gas 473.34 J/mol×K 353.78 Calculated Property
Cp,gas 547.45 J/mol×K 434.56 Calculated Property
Cp,gas 610.20 J/mol×K 515.33 Calculated Property
Cp,gas 662.74 J/mol×K 596.11 Calculated Property
Cp,gas 706.25 J/mol×K 676.89 Calculated Property
Cp,gas 741.88 J/mol×K 757.67 Calculated Property
Cp,gas 770.81 J/mol×K 838.44 Calculated Property
Cp,gas 794.19 J/mol×K 919.22 Calculated Property
Cp,gas 813.18 J/mol×K 1000.00 Calculated Property

Similar Compounds

Diethylmalonic acid, butyl 2,2,3,3,4,4,4-heptafluorobutyl ester. Diethylmalonic acid, 2,2,3,3,4,4,4-heptafluorobutyl isobutyl ester. Diethylmalonic acid, 2,2,3,3,4,4,4-heptafluorobutyl pentyl ester. Diethylmalonic acid, ethyl 2,2,3,3,4,4,4-heptafluorobutyl ester. Diethylmalonic acid, 2,2,3,3,4,4,4-heptafluorobutyl hexyl ester. Diethylmalonic acid, 2,2,3,3,4,4,4-heptafluorobutyl hexadecyl ester. Diethylmalonic acid, 2,2,3,3,4,4,4-heptafluorobutyl heptyl ester. Diethylmalonic acid, 2,2,3,3,4,4,4-heptafluorobutyl undecyl ester. Diethylmalonic acid, decyl 2,2,3,3,4,4,4-heptafluorobutyl ester. Diethylmalonic acid, heptadecyl 2,2,3,3,4,4,4-heptafluorobutyl ester. Diethylmalonic acid, 2,2,3,3,4,4,4-heptafluorobutyl octyl ester. Diethylmalonic acid, 2,2,3,3,4,4,4-heptafluorobutyl tetradecyl ester. Diethylmalonic acid, 2,2,3,3,4,4,4-heptafluorobutyl pentadecyl ester. Diethylmalonic acid, 2,2,3,3,4,4,4-heptafluorobutyl octadecyl ester. Diethylmalonic acid, dodecyl 2,2,3,3,4,4,4-heptafluorobutyl ester.

Find more compounds similar to Diethylmalonic acid, 2,2,3,3,4,4,4-heptafluorobutyl propyl ester.

Sources

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