Chemical Properties of l-Phenylalanine, N-capryloyl-, methyl ester

l-Phenylalanine, N-capryloyl-, methyl ester

InChI
InChI=1S/C18H27NO3/c1-3-4-5-6-10-13-17(20)19-16(18(21)22-2)14-15-11-8-7-9-12-15/h7-9,11-12,16H,3-6,10,13-14H2,1-2H3,(H,19,20)
InChI Key
OUCOUUMRVGYPMW-UHFFFAOYSA-N
Formula
C18H27NO3
SMILES
CCCCCCCC(=O)NC(Cc1ccccc1)C(=O)OC
Molecular Weight1
305.41
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Physical Properties

Property Value Unit Source
ΔfusH° 43.96 kJ/mol Joback Calculated Property
log10WS -4.01 Relay (1.0) Calculated Property
logPoct/wat 3.247 Crippen Calculated Property
McVol 259.710 ml/mol McGowan Calculated Property
Pc 1567.23 kPa Joback Calculated Property
Inp [2222.00; 2222.00]   Show Hide
Inp 2222.00 NIST
Inp 2222.00 NIST
Tboil 613.08 K Relay (1.0) Calculated Property
Tfus 320.41 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 [786.04; 864.48] J/mol×K [799.94; 1001.60] Show Hide
Cp,gas 786.04 J/mol×K 799.94 Joback Calculated Property
Cp,gas 801.78 J/mol×K 833.55 Joback Calculated Property
Cp,gas 816.39 J/mol×K 867.16 Joback Calculated Property
Cp,gas 829.93 J/mol×K 900.77 Joback Calculated Property
Cp,gas 842.43 J/mol×K 934.38 Joback Calculated Property
Cp,gas 853.93 J/mol×K 967.99 Joback Calculated Property
Cp,gas 864.48 J/mol×K 1001.60 Joback Calculated Property

Similar Compounds

l-Phenylalanine, N-caproyl-, methyl ester. l-Phenylalanine, N-(5-chlorovaleryl)-, methyl ester. l-Phenylalanine, N-(3-cyclopentylpropionyl)-, methyl ester. l-Phenylalanine, N-butyryl-, methyl ester. L-Tyrosine, N,O-bis(capryloyl)-, methyl ester. l-Tyrosine, N,O-bis(caproyl)-, methyl ester. (-)-Jasmonic acid, - (S)-Phe conjugate, methyl ester. l-Tyrosine, N,O-bis(butyryl)-, methyl ester. l-Tyrosine, N,O-bis(3-cyclopentylpropionyl)-, methyl ester. l-Phenylalanine, n-pentafluoropropionyl-, octadecyl ester. l-Phenylalanine, n-pentafluoropropionyl-, dodecyl ester. l-Phenylalanine, n-pentafluoropropionyl-, octyl ester. l-Phenylalanine, n-pentafluoropropionyl-, undecyl ester. l-Phenylalanine, n-pentafluoropropionyl-, decyl ester. l-Phenylalanine, n-pentafluoropropionyl-, heptyl ester.

Find more compounds similar to l-Phenylalanine, N-capryloyl-, methyl ester.

Sources

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