Chemical Properties of Dimethylmalonic acid, heptadecyl 2,2,3,3-tetrafluoropropyl ester

Dimethylmalonic acid, heptadecyl 2,2,3,3-tetrafluoropropyl ester

InChI
InChI=1S/C25H44F4O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-32-22(30)24(2,3)23(31)33-20-25(28,29)21(26)27/h21H,4-20H2,1-3H3
InChI Key
QOOSCMSYKYZANB-UHFFFAOYSA-N
Formula
C25H44F4O4
SMILES
CCCCCCCCCCCCCCCCCOC(=O)C(C)(C)C(=O)OCC(F)(F)C(F)F
Molecular Weight1
484.61
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Physical Properties

Property Value Unit Source
ΔfH°gas -1955.50 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 63.21 kJ/mol Joback Calculated Property
ΔvapH° 115.33 kJ/mol Relay (1.0) Calculated Property
log10WS -7.70 Relay (1.0) Calculated Property
logPoct/wat 7.871 Crippen Calculated Property
McVol 385.070 ml/mol McGowan Calculated Property
Inp [2501.00; 2501.00]   Show Hide
Inp 2501.00 NIST
Inp 2501.00 NIST
Tboil 621.78 K Relay (1.0) Calculated Property
Tfus 314.28 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy 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 [598.06; 1357.08] 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 A4.71700e+00
Coefficient B2.57396e+00
Coefficient C-1.55940e-03
Coefficient D3.37800e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 598.06 J/mol×K 273.00 Calculated Property
Cp,gas 735.11 J/mol×K 353.78 Calculated Property
Cp,gas 856.49 J/mol×K 434.56 Calculated Property
Cp,gas 963.27 J/mol×K 515.33 Calculated Property
Cp,gas 1056.51 J/mol×K 596.11 Calculated Property
Cp,gas 1137.28 J/mol×K 676.89 Calculated Property
Cp,gas 1206.66 J/mol×K 757.67 Calculated Property
Cp,gas 1265.70 J/mol×K 838.44 Calculated Property
Cp,gas 1315.49 J/mol×K 919.22 Calculated Property
Cp,gas 1357.08 J/mol×K 1000.00 Calculated Property

Similar Compounds

Dimethylmalonic acid, nonyl 2,2,3,3-tetrafluoropropyl ester. Dimethylmalonic acid, octyl 2,2,3,3-tetrafluoropropyl ester. Dimethylmalonic acid, decyl 2,2,3,3-tetrafluoropropyl ester. Dimethylmalonic acid, 2,2,3,3-tetrafluoropropyl undecyl ester. Dimethylmalonic acid, 2,2,3,3-tetrafluoropropyl tridecyl ester. Dimethylmalonic acid, dodecyl 2,2,3,3-tetrafluoropropyl ester. Dimethylmalonic acid, octadecyl 2,2,3,3-tetrafluoropropyl ester. Dimethylmalonic acid, hexadecyl 2,2,3,3-tetrafluoropropyl ester. Dimethylmalonic acid, tetradecyl 2,2,3,3-tetrafluoropropyl ester. Dimethylmalonic acid, heptyl 2,2,3,3-tetrafluoropropyl ester. Dimethylmalonic acid, hexyl 2,2,3,3-tetrafluoropropyl ester. Dimethylmalonic acid, pentyl 2,2,3,3-tetrafluoropropyl ester. Dimethylmalonic acid, octadecyl 2,2,3,3,3-pentafluoropropyl ester. Dimethylmalonic acid, heptadecyl 2,2,3,3,3-pentafluoropropyl ester. Dimethylmalonic acid, decyl 2,2,3,3,3-pentafluoropropyl ester.

Find more compounds similar to Dimethylmalonic acid, heptadecyl 2,2,3,3-tetrafluoropropyl ester.

Sources

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