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

l-Phenylalanine, n-heptafluorobutyryl-, pentyl ester

InChI
InChI=1S/C18H20F7NO3/c1-2-3-7-10-29-14(27)13(11-12-8-5-4-6-9-12)26-15(28)16(19,20)17(21,22)18(23,24)25/h4-6,8-9,13H,2-3,7,10-11H2,1H3,(H,26,28)
InChI Key
IWPULFBBUCUDMG-UHFFFAOYSA-N
Formula
C18H20F7NO3
SMILES
CCCCCOC(=O)C(Cc1ccccc1)NC(=O)C(F)(F)C(F)(F)C(F)(F)F
Molecular Weight1
431.35
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Physical Properties

Property Value Unit Source
ΔfusH° 43.28 kJ/mol Joback Calculated Property
log10WS -5.64 Relay (1.0) Calculated Property
logPoct/wat 4.280 Crippen Calculated Property
McVol 272.100 ml/mol McGowan Calculated Property
Pc 1290.21 kPa Joback Calculated Property
Inp [1818.00; 1818.00]   Show Hide
Inp 1818.00 NIST
Inp 1818.00 NIST
Tboil 588.11 K Relay (1.0) Calculated Property
Tfus 309.89 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [844.01; 909.85] J/mol×K [785.14; 970.60] Show Hide
Cp,gas 844.01 J/mol×K 785.14 Joback Calculated Property
Cp,gas 857.16 J/mol×K 816.05 Joback Calculated Property
Cp,gas 869.34 J/mol×K 846.96 Joback Calculated Property
Cp,gas 880.62 J/mol×K 877.87 Joback Calculated Property
Cp,gas 891.09 J/mol×K 908.78 Joback Calculated Property
Cp,gas 900.80 J/mol×K 939.69 Joback Calculated Property
Cp,gas 909.85 J/mol×K 970.60 Joback Calculated Property

Similar Compounds

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

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

Sources

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