Chemical Properties of L-Phenylalanine, N-(2,6-difluorobenzoyl)-, methyl ester

L-Phenylalanine, N-(2,6-difluorobenzoyl)-, methyl ester

InChI
InChI=1S/C17H15F2NO3/c1-23-17(22)14(10-11-6-3-2-4-7-11)20-16(21)15-12(18)8-5-9-13(15)19/h2-9,14H,10H2,1H3,(H,20,21)
InChI Key
JAKBXLAQIOZZHD-UHFFFAOYSA-N
Formula
C17H15F2NO3
SMILES
COC(=O)C(Cc1ccccc1)NC(=O)c1c(F)cccc1F
Molecular Weight1
319.31
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Physical Properties

Property Value Unit Source
ΔfusH° 39.21 kJ/mol Joback Calculated Property
log10WS -4.32 Relay (1.0) Calculated Property
logPoct/wat 2.479 Crippen Calculated Property
McVol 225.400 ml/mol McGowan Calculated Property
Inp [2216.00; 2216.00]   Show Hide
Inp 2216.00 NIST
Inp 2216.00 NIST
Tboil 625.57 K Relay (1.0) Calculated Property

Cheméo can also estimate 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 [653.48; 711.79] J/mol×K [830.11; 1051.68] Show Hide
Cp,gas 653.48 J/mol×K 830.11 Joback Calculated Property
Cp,gas 665.78 J/mol×K 867.04 Joback Calculated Property
Cp,gas 676.99 J/mol×K 903.97 Joback Calculated Property
Cp,gas 687.16 J/mol×K 940.90 Joback Calculated Property
Cp,gas 696.32 J/mol×K 977.82 Joback Calculated Property
Cp,gas 704.51 J/mol×K 1014.75 Joback Calculated Property
Cp,gas 711.79 J/mol×K 1051.68 Joback Calculated Property

Similar Compounds

l-Phenylalanine, N-(2-fluorobenzoyl)-, methyl ester. l-Phenylalanine, N-(2,3,4-trifluorobenzoyl)-, methyl ester. L-Tyrosine, N,O-bis(2,6-difluorobenzoyl)-, methyl ester. l-Phenylalanine, N-(4-fluorobenzoyl)-, methyl ester. L-Phenylalanine, N-(3-fluorobenzoyl)-, methyl ester. L-Tyrosine, N,O-bis(2-fluorobenzoyl)-, methyl ester. l-Phenylalanine-, N-(p-toluoyl)-, methyl ester. l-Tyrosine, N,O-bis(2,3,4-trifluorobenzoyl)-, methyl ester. L-Phenylalanine, N-(4-bromobenzoyl)-, methyl ester. l-Phenylalanine, N-(3-trifluoromethylbenzoyl)-, methyl ester. L-Phenylalanine, N-(2-thienylcarbonyl)-, methyl ester. L-phenylalanine, n-(4-butylbenzoyl)-, methyl ester. L-Phenylalanine, N-(2-chlorobenzoyl)-, methyl ester. l-Phenylalanine, N-(2-trifluoromethylbenzoyl)-, methyl ester. l-Tyrosine, N,O-bis(4-fluorobenzoyl)-, methyl ester.

Find more compounds similar to L-Phenylalanine, N-(2,6-difluorobenzoyl)-, methyl ester.

Sources

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