Chemical Properties of Malonic acid, heptyl 2,2,3,3,4,4,5,5-octafluoropentyl ester

Malonic acid, heptyl 2,2,3,3,4,4,5,5-octafluoropentyl ester

InChI
InChI=1S/C15H20F8O4/c1-2-3-4-5-6-7-26-10(24)8-11(25)27-9-13(18,19)15(22,23)14(20,21)12(16)17/h12H,2-9H2,1H3
InChI Key
NXQYEFBWCQBWPG-UHFFFAOYSA-N
Formula
C15H20F8O4
SMILES
CCCCCCCOC(=O)CC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F
Molecular Weight1
416.30
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Physical Properties

Property Value Unit Source
ΔfusH° 42.22 kJ/mol Joback Calculated Property
ΔvapH° 88.72 kJ/mol Relay (1.0) Calculated Property
log10WS -5.85 Relay (1.0) Calculated Property
logPoct/wat 4.604 Crippen Calculated Property
McVol 251.250 ml/mol McGowan Calculated Property
Inp [1637.00; 1637.00]   Show Hide
Inp 1637.00 NIST
Inp 1637.00 NIST
Tboil 547.29 K Relay (1.0) Calculated Property
Tfus 251.67 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation 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.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [417.26; 870.92] 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 A1.36980e+01
Coefficient B1.79692e+00
Coefficient C-1.25280e-03
Coefficient D3.13100e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 417.26 J/mol×K 273.00 Calculated Property
Cp,gas 506.47 J/mol×K 353.78 Calculated Property
Cp,gas 583.68 J/mol×K 434.56 Calculated Property
Cp,gas 649.86 J/mol×K 515.33 Calculated Property
Cp,gas 706.00 J/mol×K 596.11 Calculated Property
Cp,gas 753.11 J/mol×K 676.89 Calculated Property
Cp,gas 792.16 J/mol×K 757.67 Calculated Property
Cp,gas 824.16 J/mol×K 838.44 Calculated Property
Cp,gas 850.08 J/mol×K 919.22 Calculated Property
Cp,gas 870.92 J/mol×K 1000.00 Calculated Property

Similar Compounds

Malonic acid, 2,2,3,3,4,4,5,5-octafluoropentyl octyl ester. Malonic acid, nonyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Malonic acid, decyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Malonic acid, hexyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Malonic acid, 2,2,3,3,4,4,5,5-octafluoropentyl pentyl ester. Malonic acid, butyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Succinic acid, 2,2,3,3,4,4,5,5-octafluoropentyl heptadecyl ester. Sebacic acid, 2,2,3,3,4,4,5,5-octafluoropentyl octyl ester. Sebacic acid, 2,2,3,3,4,4,5,5-octafluoropentyl tridecyl ester. Sebacic acid, 2,2,3,3,4,4,5,5-octafluoropentyl pentadecyl ester. Sebacic acid, dodecyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Sebacic acid, 2,2,3,3,4,4,5,5-octafluoropentyl undecyl ester. Sebacic acid, hexadecyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Adipic acid, heptyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Sebacic acid, 2,2,3,3,4,4,5,5-octafluoropentyl tetradecyl ester.

Find more compounds similar to Malonic acid, heptyl 2,2,3,3,4,4,5,5-octafluoropentyl ester.

Sources

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