Chemical Properties of Succinic acid, 2-chloro-6-fluorobenzyl tridecyl ester

Succinic acid, 2-chloro-6-fluorobenzyl tridecyl ester

InChI
InChI=1S/C24H36ClFO4/c1-2-3-4-5-6-7-8-9-10-11-12-18-29-23(27)16-17-24(28)30-19-20-21(25)14-13-15-22(20)26/h13-15H,2-12,16-19H2,1H3
InChI Key
VMZMLDFPHJUDMD-UHFFFAOYSA-N
Formula
C24H36ClFO4
SMILES
CCCCCCCCCCCCCOC(=O)CCC(=O)OCc1c(F)cccc1Cl
Molecular Weight1
442.99
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Physical Properties

Property Value Unit Source
ΔfusH° 67.19 kJ/mol Joback Calculated Property
ΔvapH° 124.21 kJ/mol Relay (1.0) Calculated Property
log10WS -7.47 Relay (1.0) Calculated Property
logPoct/wat 7.157 Crippen Calculated Property
McVol 354.150 ml/mol McGowan Calculated Property
Pc 922.18 kPa Joback Calculated Property
Inp [3008.00; 3008.00]   Show Hide
Inp 3008.00 NIST
Inp 3008.00 NIST
Tboil 672.76 K Relay (1.0) Calculated Property
Tfus 323.53 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, 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 [516.73; 1164.47] 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 A4.55650e+01
Coefficient B1.99492e+00
Coefficient C-1.02652e-03
Coefficient D1.50500e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 516.73 J/mol×K 273.00 Calculated Property
Cp,gas 629.51 J/mol×K 353.78 Calculated Property
Cp,gas 730.97 J/mol×K 434.56 Calculated Property
Cp,gas 821.60 J/mol×K 515.33 Calculated Property
Cp,gas 901.87 J/mol×K 596.11 Calculated Property
Cp,gas 972.25 J/mol×K 676.89 Calculated Property
Cp,gas 1033.23 J/mol×K 757.67 Calculated Property
Cp,gas 1085.27 J/mol×K 838.44 Calculated Property
Cp,gas 1128.86 J/mol×K 919.22 Calculated Property
Cp,gas 1164.47 J/mol×K 1000.00 Calculated Property

Similar Compounds

Succinic acid, 2-chloro-6-fluorobenzyl hexadecyl ester. Succinic acid, 2-chloro-6-fluorobenzyl nonyl ester. Succinic acid, 2-chloro-6-fluorobenzyl heptyl ester. Succinic acid, 2-chloro-6-fluorobenzyl pentadecyl ester. Succinic acid, 2-chloro-6-fluorobenzyl octyl ester. Succinic acid, 2-chloro-6-fluorobenzyl dodecyl ester. Succinic acid, 2-chloro-6-fluorobenzyl tetradecyl ester. Succinic acid, 2-chloro-6-fluorobenzyl undecyl ester. Succinic acid, 2-chloro-6-fluorobenzyl hexyl ester. Succinic acid, 2-chloro-6-fluorobenzyl pentyl ester. Succinic acid, butyl 2-chloro-6-fluorobenzyl ester. Succinic acid, 2-chloro-6-fluorobenzyl propyl ester. Succinic acid, 2-chloro-6-fluorobenzyl 2-methylhex-3-yl ester. Succinic acid, 2-chloro-6-fluorobenzyl isobutyl ester. 2-Chloro-6-fluorobenzyl alcohol, n-pentyl ether.

Find more compounds similar to Succinic acid, 2-chloro-6-fluorobenzyl tridecyl ester.

Sources

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