Chemical Properties of D-Alanine, N-(2,4,5-trifluoro-3-methoxybenzoyl)-, ethyl ester

D-Alanine, N-(2,4,5-trifluoro-3-methoxybenzoyl)-, ethyl ester

InChI
InChI=1S/C13H14F3NO4/c1-4-21-13(19)6(2)17-12(18)7-5-8(14)10(16)11(20-3)9(7)15/h5-6H,4H2,1-3H3,(H,17,18)
InChI Key
AVEFJQGYAPMVDP-UHFFFAOYSA-N
Formula
C13H14F3NO4
SMILES
CCOC(=O)C(C)NC(=O)c1cc(F)c(F)c(OC)c1F
Molecular Weight1
305.25
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Physical Properties

Property Value Unit Source
ΔfusH° 38.30 kJ/mol Joback Calculated Property
logPoct/wat 1.794 Crippen Calculated Property
McVol 200.440 ml/mol McGowan Calculated Property
Inp [1890.00; 1890.00]   Show Hide
Inp 1890.00 NIST
Inp 1890.00 NIST
Tboil 568.26 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, Log10 of Water solubility in mol/l 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 [560.54; 619.77] J/mol×K [743.56; 937.11] Show Hide
Cp,gas 560.54 J/mol×K 743.56 Joback Calculated Property
Cp,gas 572.31 J/mol×K 775.82 Joback Calculated Property
Cp,gas 583.33 J/mol×K 808.08 Joback Calculated Property
Cp,gas 593.60 J/mol×K 840.34 Joback Calculated Property
Cp,gas 603.09 J/mol×K 872.60 Joback Calculated Property
Cp,gas 611.82 J/mol×K 904.85 Joback Calculated Property
Cp,gas 619.77 J/mol×K 937.11 Joback Calculated Property

Similar Compounds

D-Alanine, N-(2,4,5-trifluoro-3-methoxybenzoyl)-, propyl ester. D-Alanine, N-(2,4,5-trifluoro-3-methoxybenzoyl)-, nonadecyl ester. D-Alanine, N-(2,4,5-trifluoro-3-methoxybenzoyl)-, heptadecyl ester. D-Alanine, N-(2,4,5-trifluoro-3-methoxybenzoyl)-, hexadecyl ester. D-Alanine, N-(2,4,5-trifluoro-3-methoxybenzoyl)-, isohexyl ester. L-Valine, N-(3-methoxy-2,4,5-trifluorobenzoyl)-, butyl ester. L-Valine, N-(3-methoxy-2,4,5-trifluorobenzoyl)-, hexadecyl ester. L-Valine, N-(3-methoxy-2,4,5-trifluorobenzoyl)-, pentadecyl ester. L-Valine, N-(3-methoxy-2,4,5-trifluorobenzoyl)-, heptyl ester. L-Valine, N-(3-methoxy-2,4,5-trifluorobenzoyl)-, tetradecyl ester. L-Valine, N-(3-methoxy-2,4,5-trifluorobenzoyl)-, octadecyl ester. L-Valine, N-(3-methoxy-2,4,5-trifluorobenzoyl)-, undecyl ester. L-Valine, N-(3-methoxy-2,4,5-trifluorobenzoyl)-, heptadecyl ester. L-Valine, N-(3-methoxy-2,4,5-trifluorobenzoyl)-, decyl ester. L-Valine, N-(3-methoxy-2,4,5-trifluorobenzoyl)-, isohexyl ester.

Find more compounds similar to D-Alanine, N-(2,4,5-trifluoro-3-methoxybenzoyl)-, ethyl ester.

Sources

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