Chemical Properties of Diethylmalonic acid, pentadecyl 2,3,4-trifluorophenyl ester

Diethylmalonic acid, pentadecyl 2,3,4-trifluorophenyl ester

InChI
InChI=1S/C28H43F3O4/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-21-34-26(32)28(5-2,6-3)27(33)35-23-20-19-22(29)24(30)25(23)31/h19-20H,4-18,21H2,1-3H3
InChI Key
RAXAEPIBSPGKKG-UHFFFAOYSA-N
Formula
C28H43F3O4
SMILES
CCCCCCCCCCCCCCCOC(=O)C(CC)(CC)C(=O)Oc1ccc(F)c(F)c1F
Molecular Weight1
500.64
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Physical Properties

Property Value Unit Source
ΔfusH° 71.71 kJ/mol Joback Calculated Property
log10WS -8.44 Relay (1.0) Calculated Property
logPoct/wat 8.450 Crippen Calculated Property
McVol 401.810 ml/mol McGowan Calculated Property
Pc 720.30 kPa Joback Calculated Property
Inp [2902.00; 2902.00]   Show Hide
Inp 2902.00 NIST
Inp 2902.00 NIST
Tboil 665.75 K Relay (1.0) Calculated Property
Tfus 312.89 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1371.70; 1453.61] J/mol×K [992.88; 1223.33] Show Hide
Cp,gas 1371.70 J/mol×K 992.88 Joback Calculated Property
Cp,gas 1389.46 J/mol×K 1031.29 Joback Calculated Property
Cp,gas 1405.47 J/mol×K 1069.70 Joback Calculated Property
Cp,gas 1419.81 J/mol×K 1108.10 Joback Calculated Property
Cp,gas 1432.55 J/mol×K 1146.51 Joback Calculated Property
Cp,gas 1443.79 J/mol×K 1184.92 Joback Calculated Property
Cp,gas 1453.61 J/mol×K 1223.33 Joback Calculated Property

Similar Compounds

Diethylmalonic acid, tridecyl 2,3,4-trifluorophenyl ester. Diethylmalonic acid, 2,3,4-trifluorophenyl undecyl ester. Diethylmalonic acid, nonyl 2,3,4-trifluorophenyl ester. Diethylmalonic acid, dodecyl 2,3,4-trifluorophenyl ester. Diethylmalonic acid, tetradecyl 2,3,4-trifluorophenyl ester. Diethylmalonic acid, hexadecyl 2,3,4-trifluorophenyl ester. Diethylmalonic acid, decyl 2,3,4-trifluorophenyl ester. Diethylmalonic acid, heptadecyl 2,3,4-trifluorophenyl ester. Diethylmalonic acid, octadecyl 2,3,4-trifluorophenyl ester. Diethylmalonic acid, octyl 2,3,4-trifluorophenyl ester. Diethylmalonic acid, hexyl 2,3,4-trifluorophenyl ester. Diethylmalonic acid, pentyl 2,3,4-trifluorophenyl ester. Diethylmalonic acid, butyl 2,3,4-trifluorophenyl ester. Diethylmalonic acid, propyl 2,3,4-trifluorophenyl ester. Diethylmalonic acid, 3-fluorophenyl hexyl ester.

Find more compounds similar to Diethylmalonic acid, pentadecyl 2,3,4-trifluorophenyl ester.

Sources

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