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

l-Phenylalanine, n-pentafluoropropionyl-, decyl ester

InChI
InChI=1S/C22H30F5NO3/c1-2-3-4-5-6-7-8-12-15-31-19(29)18(16-17-13-10-9-11-14-17)28-20(30)21(23,24)22(25,26)27/h9-11,13-14,18H,2-8,12,15-16H2,1H3,(H,28,30)
InChI Key
UVEMRDVEVRJYRW-UHFFFAOYSA-N
Formula
C22H30F5NO3
SMILES
CCCCCCCCCCOC(=O)C(Cc1ccccc1)NC(=O)C(F)(F)C(F)(F)F
Molecular Weight1
451.47
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Physical Properties

Property Value Unit Source
ΔfusH° 54.89 kJ/mol Joback Calculated Property
log10WS -6.52 Relay (1.0) Calculated Property
logPoct/wat 5.595 Crippen Calculated Property
McVol 324.920 ml/mol McGowan Calculated Property
Pc 1042.60 kPa Joback Calculated Property
Inp [2277.00; 2277.00]   Show Hide
Inp 2277.00 NIST
Inp 2277.00 NIST
Tboil 628.17 K Relay (1.0) Calculated Property
Tfus 326.60 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 [486.13; 1108.65] 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-3.96300e+01
Coefficient B2.32482e+00
Coefficient C-1.56830e-03
Coefficient D3.91760e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 486.13 J/mol×K 273.00 Calculated Property
Cp,gas 603.90 J/mol×K 353.78 Calculated Property
Cp,gas 706.63 J/mol×K 434.56 Calculated Property
Cp,gas 795.55 J/mol×K 515.33 Calculated Property
Cp,gas 871.91 J/mol×K 596.11 Calculated Property
Cp,gas 936.95 J/mol×K 676.89 Calculated Property
Cp,gas 991.91 J/mol×K 757.67 Calculated Property
Cp,gas 1038.01 J/mol×K 838.44 Calculated Property
Cp,gas 1076.52 J/mol×K 919.22 Calculated Property
Cp,gas 1108.65 J/mol×K 1000.00 Calculated Property

Similar Compounds

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

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

Sources

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