Chemical Properties of Isophthalic acid, dodecyl 2,2,3,3,4,4,5,5-octafluoropentyl ester

Isophthalic acid, dodecyl 2,2,3,3,4,4,5,5-octafluoropentyl ester

InChI
InChI=1S/C25H32F8O4/c1-2-3-4-5-6-7-8-9-10-11-15-36-20(34)18-13-12-14-19(16-18)21(35)37-17-23(28,29)25(32,33)24(30,31)22(26)27/h12-14,16,22H,2-11,15,17H2,1H3
InChI Key
KZDIOFVHNZAQPK-UHFFFAOYSA-N
Formula
C25H32F8O4
SMILES
CCCCCCCCCCCCOC(=O)c1cccc(C(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F)c1
Molecular Weight1
548.51
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Physical Properties

Property Value Unit Source
ω 1.1951 Relay (1.0) Calculated Property
ΔfusH° 61.77 kJ/mol Joback Calculated Property
log10WS -8.80 Relay (1.0) Calculated Property
logPoct/wat 8.092 Crippen Calculated Property
McVol 368.390 ml/mol McGowan Calculated Property
Pc 777.21 kPa Joback Calculated Property
Inp [2667.00; 2667.00]   Show Hide
Inp 2667.00 NIST
Inp 2667.00 NIST
Tboil 676.97 K Relay (1.0) Calculated Property
Tc 838.73 K Relay (1.0) Calculated Property
Tfus 315.49 K Relay (1.0) Calculated Property
Vc 1.387 m3/kmol Relay (1.0) Calculated Property

Cheméo can also estimate Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, 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 [574.69; 1265.26] 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-1.49980e+01
Coefficient B2.60852e+00
Coefficient C-1.76096e-03
Coefficient D4.32700e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 574.69 J/mol×K 273.00 Calculated Property
Cp,gas 706.60 J/mol×K 353.78 Calculated Property
Cp,gas 821.52 J/mol×K 434.56 Calculated Property
Cp,gas 920.82 J/mol×K 515.33 Calculated Property
Cp,gas 1005.87 J/mol×K 596.11 Calculated Property
Cp,gas 1078.04 J/mol×K 676.89 Calculated Property
Cp,gas 1138.70 J/mol×K 757.67 Calculated Property
Cp,gas 1189.21 J/mol×K 838.44 Calculated Property
Cp,gas 1230.94 J/mol×K 919.22 Calculated Property
Cp,gas 1265.26 J/mol×K 1000.00 Calculated Property

Similar Compounds

Isophthalic acid, 2,2,3,3,4,4,5,5-octafluoropentyl tridecyl ester. Isophthalic acid, octadecyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Isophthalic acid, heptyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Isophthalic acid, heptadecyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Isophthalic acid, hexadecyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Isophthalic acid, 2,2,3,3,4,4,5,5-octafluoropentyl octyl ester. Isophthalic acid, 2,2,3,3,4,4,5,5-octafluoropentyl pentadecyl ester. Isophthalic acid, 2,2,3,3,4,4,5,5-octafluoropentyl undecyl ester. Isophthalic acid, nonyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Isophthalic acid, 2,2,3,3,4,4,5,5-octafluoropentyl tetradecyl ester. Isophthalic acid, decyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Terephthalic acid, 2,2,3,3,4,4,4-heptafluorobutyl octyl ester. Terephthalic acid, decyl 2,2,3,3,4,4,4-heptafluorobutyl ester. Terephthalic acid, dodecyl 2,2,3,3,4,4,4-heptafluorobutyl ester. Terephthalic acid, heptadecyl 2,2,3,3,4,4,4-heptafluorobutyl ester.

Find more compounds similar to Isophthalic acid, dodecyl 2,2,3,3,4,4,5,5-octafluoropentyl ester.

Sources

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