Chemical Properties of Diethylmalonic acid, decyl 3-fluorophenyl ester

Diethylmalonic acid, decyl 3-fluorophenyl ester

InChI
InChI=1S/C23H35FO4/c1-4-7-8-9-10-11-12-13-17-27-21(25)23(5-2,6-3)22(26)28-20-16-14-15-19(24)18-20/h14-16,18H,4-13,17H2,1-3H3
InChI Key
XRPIEXBLDQKNKN-UHFFFAOYSA-N
Formula
C23H35FO4
SMILES
CCCCCCCCCCOC(=O)C(CC)(CC)C(=O)Oc1cccc(F)c1
Molecular Weight1
394.52
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Physical Properties

Property Value Unit Source
ΔfusH° 53.38 kJ/mol Joback Calculated Property
log10WS -6.48 Relay (1.0) Calculated Property
logPoct/wat 6.221 Crippen Calculated Property
McVol 327.820 ml/mol McGowan Calculated Property
Pc 1023.34 kPa Joback Calculated Property
Inp [2448.00; 2448.00]   Show Hide
Inp 2448.00 NIST
Inp 2448.00 NIST
Tboil 641.06 K Relay (1.0) Calculated Property
Tfus 304.03 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 [1051.01; 1132.84] J/mol×K [869.98; 1069.34] Show Hide
Cp,gas 1051.01 J/mol×K 869.98 Joback Calculated Property
Cp,gas 1067.67 J/mol×K 903.21 Joback Calculated Property
Cp,gas 1083.05 J/mol×K 936.43 Joback Calculated Property
Cp,gas 1097.21 J/mol×K 969.66 Joback Calculated Property
Cp,gas 1110.19 J/mol×K 1002.89 Joback Calculated Property
Cp,gas 1122.05 J/mol×K 1036.11 Joback Calculated Property
Cp,gas 1132.84 J/mol×K 1069.34 Joback Calculated Property

Similar Compounds

Diethylmalonic acid, 3-fluorophenyl nonyl ester. Diethylmalonic acid, dodecyl 3-fluorophenyl ester. Diethylmalonic acid, 3-fluorophenyl hexyl ester. Diethylmalonic acid, 3-fluorophenyl undecyl ester. Diethylmalonic acid, 3-fluorophenyl pentyl ester. Diethylmalonic acid, butyl 3-fluorophenyl ester. Diethylmalonic acid, 2-fluorophenyl nonyl ester. Diethylmalonic acid, 2-fluorophenyl hexadecyl ester. Diethylmalonic acid, 2-fluorophenyl pentadecyl ester. Diethylmalonic acid, 2-fluorophenyl hexyl ester. Diethylmalonic acid, 2-fluorophenyl octadecyl ester. Diethylmalonic acid, 2-fluorophenyl octyl ester. Diethylmalonic acid, 2-fluorophenyl heptyl ester. Diethylmalonic acid, 2-fluorophenyl tridecyl ester. Diethylmalonic acid, 2-fluorophenyl heptadecyl ester.

Find more compounds similar to Diethylmalonic acid, decyl 3-fluorophenyl ester.

Sources

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