Chemical Properties of Sebacic acid, di(4-trifluoromethoxybenzyl) ester

Sebacic acid, di(4-trifluoromethoxybenzyl) ester

InChI
InChI=1S/C26H28F6O6/c27-25(28,29)37-21-13-9-19(10-14-21)17-35-23(33)7-5-3-1-2-4-6-8-24(34)36-18-20-11-15-22(16-12-20)38-26(30,31)32/h9-16H,1-8,17-18H2
InChI Key
JMHRXKACIBAHAX-UHFFFAOYSA-N
Formula
C26H28F6O6
SMILES
O=C(CCCCCCCCC(=O)OCc1ccc(OC(F)(F)F)cc1)OCc1ccc(OC(F)(F)F)cc1
Molecular Weight1
550.49
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Physical Properties

Property Value Unit Source
ΔfusH° 65.17 kJ/mol Joback Calculated Property
logPoct/wat 7.391 Crippen Calculated Property
McVol 366.920 ml/mol McGowan Calculated Property
Inp [2759.00; 2759.00]   Show Hide
Inp 2759.00 NIST
Inp 2759.00 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [557.38; 1216.14] 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 A2.94600e+01
Coefficient B2.28340e+00
Coefficient C-1.34972e-03
Coefficient D2.53000e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 557.38 J/mol×K 273.00 Calculated Property
Cp,gas 679.55 J/mol×K 353.78 Calculated Property
Cp,gas 787.61 J/mol×K 434.56 Calculated Property
Cp,gas 882.35 J/mol×K 515.33 Calculated Property
Cp,gas 964.59 J/mol×K 596.11 Calculated Property
Cp,gas 1035.12 J/mol×K 676.89 Calculated Property
Cp,gas 1094.74 J/mol×K 757.67 Calculated Property
Cp,gas 1144.25 J/mol×K 838.44 Calculated Property
Cp,gas 1184.45 J/mol×K 919.22 Calculated Property
Cp,gas 1216.14 J/mol×K 1000.00 Calculated Property

Similar Compounds

Glutaric acid, di(4-(trifluoromethoxy)benzyl) ester. Anisyl heptanoate. Sebacic acid, propyl 4-trifluoromethoxybenzyl ester. Anisyl valerate. Sebacic acid, butyl 4-trifluoromethoxybenzyl ester. Sebacic acid, ethyl 4-methoxybenzyl ester. Glutaric acid, ethyl 4-(trifluoromethoxy)benzyl ester. Pimelic acid, ethyl 4-methoxybenzyl ester. Sebacic acid, decyl 4-trifluoromethoxybenzyl ester. Sebacic acid, nonyl 4-trifluoromethoxybenzyl ester. Sebacic acid, 4-trifluoromethoxybenzyl undecyl ester. Sebacic acid, pentyl 4-trifluoromethoxybenzyl ester. Sebacic acid, heptyl 4-trifluoromethoxybenzyl ester. Sebacic acid, octyl 4-trifluoromethoxybenzyl ester. Sebacic acid, hexyl 4-trifluoromethoxybenzyl ester.

Find more compounds similar to Sebacic acid, di(4-trifluoromethoxybenzyl) ester.

Sources

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