Chemical Properties of Fumaric acid, pentafluorobenzyl naphth-2-ylmethyl ester

Fumaric acid, pentafluorobenzyl naphth-2-ylmethyl ester

InChI
InChI=1S/C22H13F5O4/c23-18-15(19(24)21(26)22(27)20(18)25)11-31-17(29)8-7-16(28)30-10-12-5-6-13-3-1-2-4-14(13)9-12/h1-9H,10-11H2/b8-7-
InChI Key
GMUUXZYTMUABJY-BQYQJAHWSA-N
Formula
C22H13F5O4
SMILES
O=C(/C=C/C(=O)OCc1c(F)c(F)c(F)c(F)c1F)OCc1ccc2ccccc2c1
Molecular Weight1
436.33
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Physical Properties

Property Value Unit Source
ΔfusH° 59.84 kJ/mol Joback Calculated Property
IE 8.61 eV Relay (1.0) Calculated Property
logPoct/wat 4.878 Crippen Calculated Property
McVol 273.290 ml/mol McGowan Calculated Property
Inp [2846.00; 2846.00]   Show Hide
Inp 2846.00 NIST
Inp 2846.00 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [391.64; 829.24] 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 A3.65220e+01
Coefficient B1.54470e+00
Coefficient C-9.46480e-04
Coefficient D1.94500e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 391.64 J/mol×K 273.00 Calculated Property
Cp,gas 473.15 J/mol×K 353.78 Calculated Property
Cp,gas 545.01 J/mol×K 434.56 Calculated Property
Cp,gas 607.82 J/mol×K 515.33 Calculated Property
Cp,gas 662.21 J/mol×K 596.11 Calculated Property
Cp,gas 708.78 J/mol×K 676.89 Calculated Property
Cp,gas 748.15 J/mol×K 757.67 Calculated Property
Cp,gas 780.94 J/mol×K 838.44 Calculated Property
Cp,gas 807.77 J/mol×K 919.22 Calculated Property
Cp,gas 829.24 J/mol×K 1000.00 Calculated Property

Similar Compounds

Glutaric acid, naphth-2-ylmethyl pentafluorobenzyl ester. Fumaric acid, 2,6-dichlorophenyl naphth-2-ylmethyl ester. Fumaric acid, 4-chlorophenyl naphth-2-ylmethyl ester. Fumaric acid, 2-phenethyl naphth-2-ylmethyl ester. Fumaric acid, 3-chlorophenyl naphth-2-ylmethyl ester. Fumaric acid, pentafluorobenzyl 4-chloro-3-methylphenyl ester. Fumaric acid, 4-methoxyphenyl naphth-2-ylmethyl ester. Fumaric acid, naphth-2-yl naphth-2-ylmethyl ester. Fumaric acid, naphth-1-yl naphth-2-ylmethyl ester. Fumaric acid, 2-pentyl naphth-2-ylmethyl ester. Fumaric acid, 2-methylphenyl naphth-2-ylmethyl ester. Fumaric acid, 2,4,6-trichlorophenyl naphth-2-ylmethyl ester. Fumaric acid, 4-nitrophenyl naphth-2-ylmethyl ester. Fumaric acid, 2-methoxyphenyl naphth-2-ylmethyl ester. Fumaric acid, 2,4-dichlorophenyl naphth-2-ylmethyl ester.

Find more compounds similar to Fumaric acid, pentafluorobenzyl naphth-2-ylmethyl ester.

Sources

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