Chemical Properties of D-Alanine, N-(4-ethylbenzoyl)-, tridecyl ester

D-Alanine, N-(4-ethylbenzoyl)-, tridecyl ester

InChI
InChI=1S/C25H41NO3/c1-4-6-7-8-9-10-11-12-13-14-15-20-29-25(28)21(3)26-24(27)23-18-16-22(5-2)17-19-23/h16-19,21H,4-15,20H2,1-3H3,(H,26,27)
InChI Key
RFOAMGMVCXIRJL-UHFFFAOYSA-N
Formula
C25H41NO3
SMILES
CCCCCCCCCCCCCOC(=O)C(C)NC(=O)c1ccc(CC)cc1
Molecular Weight1
403.60
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Physical Properties

Property Value Unit Source
ΔfusH° 61.70 kJ/mol Joback Calculated Property
log10WS -6.66 Relay (1.0) Calculated Property
logPoct/wat 6.222 Crippen Calculated Property
McVol 358.340 ml/mol McGowan Calculated Property
Pc 968.68 kPa Joback Calculated Property
Inp 3130.00 NIST
Tboil 665.59 K Relay (1.0) Calculated Property
Tfus 328.74 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 [1205.55; 1287.93] J/mol×K [965.08; 1181.53] Show Hide
Cp,gas 1205.55 J/mol×K 965.08 Joback Calculated Property
Cp,gas 1222.62 J/mol×K 1001.16 Joback Calculated Property
Cp,gas 1238.26 J/mol×K 1037.23 Joback Calculated Property
Cp,gas 1252.55 J/mol×K 1073.31 Joback Calculated Property
Cp,gas 1265.55 J/mol×K 1109.38 Joback Calculated Property
Cp,gas 1277.32 J/mol×K 1145.46 Joback Calculated Property
Cp,gas 1287.93 J/mol×K 1181.53 Joback Calculated Property

Similar Compounds

D-Alanine, N-(4-ethylbenzoyl)-, dodecyl ester. D-Alanine, N-(4-ethylbenzoyl)-, decyl ester. D-Alanine, N-(4-ethylbenzoyl)-, tetradecyl ester. D-Alanine, N-(4-ethylbenzoyl)-, pentadecyl ester. D-Alanine, N-(4-ethylbenzoyl)-, nonyl ester. D-Alanine, N-(4-ethylbenzoyl)-, hexadecyl ester. D-Alanine, N-(4-ethylbenzoyl)-, undecyl ester. D-Alanine, N-(4-ethylbenzoyl)-, heptadecyl ester. D-Alanine, N-(4-ethylbenzoyl)-, heptyl ester. D-Alanine, N-(4-ethylbenzoyl)-, hexyl ester. D-Alanine, N-(4-ethylbenzoyl)-, pentyl ester. D-Alanine, N-(4-ethylbenzoyl)-, isohexyl ester. D-Alanine, N-(4-butylbenzoyl)-, pentadecyl ester. D-Alanine, N-(4-butylbenzoyl)-, tridecyl ester. D-Alanine, N-(4-butylbenzoyl)-, hexyl ester.

Find more compounds similar to D-Alanine, N-(4-ethylbenzoyl)-, tridecyl ester.

Sources

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