Chemical Properties of Glutaric acid, di(2-bromo-5-fluorobenzyl) ester

Glutaric acid, di(2-bromo-5-fluorobenzyl) ester

InChI
InChI=1S/C19H16Br2F2O4/c20-16-6-4-14(22)8-12(16)10-26-18(24)2-1-3-19(25)27-11-13-9-15(23)5-7-17(13)21/h4-9H,1-3,10-11H2
InChI Key
ZUEAJRNYXZLAQV-UHFFFAOYSA-N
Formula
C19H16Br2F2O4
SMILES
O=C(CCCC(=O)OCc1cc(F)ccc1Br)OCc1cc(F)ccc1Br
Molecular Weight1
506.13
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Physical Properties

Property Value Unit Source
ΔfusH° 56.96 kJ/mol Joback Calculated Property
logPoct/wat 5.447 Crippen Calculated Property
McVol 284.470 ml/mol McGowan Calculated Property
Inp 3001.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l 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 [381.28; 798.85] 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 A5.43850e+01
Coefficient B1.40340e+00
Coefficient C-7.90440e-04
Coefficient D1.31500e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 381.28 J/mol×K 273.00 Calculated Property
Cp,gas 457.77 J/mol×K 353.78 Calculated Property
Cp,gas 525.77 J/mol×K 434.56 Calculated Property
Cp,gas 585.68 J/mol×K 515.33 Calculated Property
Cp,gas 637.94 J/mol×K 596.11 Calculated Property
Cp,gas 682.95 J/mol×K 676.89 Calculated Property
Cp,gas 721.13 J/mol×K 757.67 Calculated Property
Cp,gas 752.90 J/mol×K 838.44 Calculated Property
Cp,gas 778.66 J/mol×K 919.22 Calculated Property
Cp,gas 798.85 J/mol×K 1000.00 Calculated Property

Similar Compounds

Glutaric acid, 2-bromo-5-fluorobenzyl ethyl ester. Sebacic acid, di(2-bromo-5-fluorobenzyl) ester. Glutaric acid, 2-bromo-5-fluorobenzyl propyl ester. Sebacic acid, 2-bromo-5-fluorobenzyl ethyl ester. Glutaric acid, 2-bromo-5-fluorobenzyl butyl ester. Glutaric acid, 2-bromo-5-fluorobenzyl isobutyl ester. Glutaric acid, 2-bromo-5-fluorobenzyl pentyl ester. Glutaric acid, 2-bromo-5-fluorobenzyl hexyl ester. Glutaric acid, di(2-bromobenzyl) ester. Glutaric acid, 2-bromo-5-fluorobenzyl nonyl ester. Glutaric acid, 2-bromo-5-fluorobenzyl hexadecyl ester. Glutaric acid, 2-bromo-5-fluorobenzyl dodecyl ester. Glutaric acid, 2-bromo-5-fluorobenzyl heptyl ester. Glutaric acid, 2-bromo-5-fluorobenzyl tridecyl ester. Glutaric acid, 2-bromo-5-fluorobenzyl tetradecyl ester.

Find more compounds similar to Glutaric acid, di(2-bromo-5-fluorobenzyl) ester.

Sources

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