Chemical Properties of Phe, HFIP-PFP

Phe, HFIP-PFP

InChI
InChI=1S/C15H10F11NO3/c16-12(17,15(24,25)26)11(29)27-8(6-7-4-2-1-3-5-7)9(28)30-10(13(18,19)20)14(21,22)23/h1-5,8,10H,6H2,(H,27,29)
InChI Key
ZJQYABQTYMRQJI-UHFFFAOYSA-N
Formula
C15H10F11NO3
SMILES
O=C(OC(C(F)(F)F)C(F)(F)F)C(Cc1ccccc1)NC(=O)C(F)(F)C(F)(F)F
Molecular Weight1
461.23
Other Names
  • Phenylalanine, HFIP-PFP
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Physical Properties

Property Value Unit Source
ΔfusH° 36.89 kJ/mol Joback Calculated Property
log10WS -5.65 Relay (1.0) Calculated Property
logPoct/wat 3.948 Crippen Calculated Property
McVol 236.910 ml/mol McGowan Calculated Property

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 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [714.84; 769.16] J/mol×K [709.91; 882.44] Show Hide
Cp,gas 714.84 J/mol×K 709.91 Joback Calculated Property
Cp,gas 725.96 J/mol×K 738.67 Joback Calculated Property
Cp,gas 736.17 J/mol×K 767.42 Joback Calculated Property
Cp,gas 745.52 J/mol×K 796.18 Joback Calculated Property
Cp,gas 754.09 J/mol×K 824.93 Joback Calculated Property
Cp,gas 761.95 J/mol×K 853.69 Joback Calculated Property
Cp,gas 769.16 J/mol×K 882.44 Joback Calculated Property

Similar Compounds

Phe,TFE-PFP. l-Phenylalanine, n-pentafluoropropionyl-, ethyl ester. l-Phenylalanine, n-pentafluoropropionyl-, propyl ester. L-phenylalanine, n-heptafluorobutyryl-, ethyl ester. Tyr, HFIP-PFP. l-Phenylalanine, n-pentafluoropropionyl-, isobutyl ester. l-Phenylalanine, n-heptafluorobutyryl-, propyl ester. L-Phenylalanine, N-pentafluoropropionyl-, butyl ester. L-Phenylalanine, N-pentafluoropropionyl-, nonyl ester. l-Phenylalanine, n-pentafluoropropionyl-, heptadecyl ester. l-Phenylalanine, n-pentafluoropropionyl-, octyl ester. l-Phenylalanine, n-pentafluoropropionyl-, pentadecyl ester. l-Phenylalanine, n-pentafluoropropionyl-, decyl ester. l-Phenylalanine, n-pentafluoropropionyl-, hexadecyl ester. l-Phenylalanine, n-pentafluoropropionyl-, undecyl ester.

Find more compounds similar to Phe, HFIP-PFP.

Sources

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