Chemical Properties of l-Phenylalanine, n-heptafluorobutyryl-, decyl ester

l-Phenylalanine, n-heptafluorobutyryl-, decyl ester

InChI
InChI=1S/C23H30F7NO3/c1-2-3-4-5-6-7-8-12-15-34-19(32)18(16-17-13-10-9-11-14-17)31-20(33)21(24,25)22(26,27)23(28,29)30/h9-11,13-14,18H,2-8,12,15-16H2,1H3,(H,31,33)
InChI Key
SQFRBKMGMQFRTF-UHFFFAOYSA-N
Formula
C23H30F7NO3
SMILES
CCCCCCCCCCOC(=O)C(Cc1ccccc1)NC(=O)C(F)(F)C(F)(F)C(F)(F)F
Molecular Weight1
501.48
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Physical Properties

Property Value Unit Source
ΔfusH° 56.23 kJ/mol Joback Calculated Property
log10WS -7.15 Relay (1.0) Calculated Property
logPoct/wat 6.231 Crippen Calculated Property
McVol 342.550 ml/mol McGowan Calculated Property
Pc 938.64 kPa Joback Calculated Property
Inp [2288.00; 2288.00]   Show Hide
Inp 2288.00 NIST
Inp 2288.00 NIST
Tboil 638.76 K Relay (1.0) Calculated Property
Tfus 318.70 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization 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 [522.28; 1175.85] 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 A-5.28300e+01
Coefficient B2.56922e+00
Coefficient C-1.82730e-03
Coefficient D4.86760e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 522.28 J/mol×K 273.00 Calculated Property
Cp,gas 648.95 J/mol×K 353.78 Calculated Property
Cp,gas 758.52 J/mol×K 434.56 Calculated Property
Cp,gas 852.52 J/mol×K 515.33 Calculated Property
Cp,gas 932.49 J/mol×K 596.11 Calculated Property
Cp,gas 999.98 J/mol×K 676.89 Calculated Property
Cp,gas 1056.52 J/mol×K 757.67 Calculated Property
Cp,gas 1103.65 J/mol×K 838.44 Calculated Property
Cp,gas 1142.92 J/mol×K 919.22 Calculated Property
Cp,gas 1175.85 J/mol×K 1000.00 Calculated Property

Similar Compounds

L-Phenylalanine, N-heptafluorobutyryl-, nonyl ester. l-Phenylalanine, n-heptafluorobutyryl-, tetradecyl ester. l-Phenylalanine, n-heptafluorobutyryl-, undecyl ester. L-Phenylalanine, N-heptafluorobutyryl-, hexadecyl ester. l-Phenylalanine, n-heptafluorobutyryl-, dodecyl ester. l-Phenylalanine, n-heptafluorobutyryl-, octadecyl ester. L-Phenylalanine, N-heptafluorobutyryl-, pentadecyl ester. l-Phenylalanine, n-heptafluorobutyryl-, heptadecyl ester. l-Phenylalanine, n-heptafluorobutyryl-, hexyl ester. l-Phenylalanine, n-heptafluorobutyryl-, pentyl ester. l-Phenylalanine, n-heptafluorobutyryl-, butyl ester. l-Phenylalanine, n-heptafluorobutyryl-, propyl ester. l-Phenylalanine, n-pentafluoropropionyl-, heptyl ester. l-Phenylalanine, n-pentafluoropropionyl-, hexadecyl ester. L-Phenylalanine, N-pentafluoropropionyl-, nonyl ester.

Find more compounds similar to l-Phenylalanine, n-heptafluorobutyryl-, decyl ester.

Sources

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