Chemical Properties of «beta»-Alanine, N-(4-ethylbenzoyl)-, ethyl ester

«beta»-Alanine, N-(4-ethylbenzoyl)-, ethyl ester

InChI
InChI=1S/C14H19NO3/c1-3-11-5-7-12(8-6-11)14(17)15-10-9-13(16)18-4-2/h5-8H,3-4,9-10H2,1-2H3,(H,15,17)
InChI Key
QKQBFLWTHBOJCP-UHFFFAOYSA-N
Formula
C14H19NO3
SMILES
CCOC(=O)CCNC(=O)c1ccc(CC)cc1
Molecular Weight1
249.31
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Physical Properties

Property Value Unit Source
ΔfH°gas -550.08 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 36.73 kJ/mol Joback Calculated Property
log10WS -3.22 Relay (1.0) Calculated Property
logPoct/wat 1.932 Crippen Calculated Property
McVol 203.350 ml/mol McGowan Calculated Property
Pc 2133.46 kPa Joback Calculated Property
Inp [2134.00; 2134.00]   Show Hide
Inp 2134.00 NIST
Inp 2134.00 NIST
Tboil 606.88 K Relay (1.0) Calculated Property
Tc 826.42 K Relay (1.0) Calculated Property
Tfus 312.33 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, 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 [562.53; 634.55] J/mol×K [713.84; 919.75] Show Hide
Cp,gas 562.53 J/mol×K 713.84 Joback Calculated Property
Cp,gas 576.88 J/mol×K 748.16 Joback Calculated Property
Cp,gas 590.26 J/mol×K 782.48 Joback Calculated Property
Cp,gas 602.69 J/mol×K 816.80 Joback Calculated Property
Cp,gas 614.20 J/mol×K 851.11 Joback Calculated Property
Cp,gas 624.81 J/mol×K 885.43 Joback Calculated Property
Cp,gas 634.55 J/mol×K 919.75 Joback Calculated Property

Similar Compounds

.BETA.-alanine, n-(4-ethylbenzoyl)-, propyl ester. «beta»-Alanine, N-(4-ethylbenzoyl)-, butyl ester. «beta»-Alanine, N-(4-ethylbenzoyl)-, isobutyl ester. .beta.-Alanine, N-(4-butylbenzoyl)-, ethyl ester. .beta.-Alanine, N-(4-ethylbenzoyl)-, octyl ester. «beta»-Alanine, N-(4-ethylbenzoyl)-, undecyl ester. «beta»-Alanine, N-(4-ethylbenzoyl)-, heptyl ester. .beta.-Alanine, N-(4-ethylbenzoyl)-, nonyl ester. .beta.-Alanine, N-(4-ethylbenzoyl)-, dodecyl ester. .beta.-Alanine, N-(4-ethylbenzoyl)-, decyl ester. .BETA.-alanine, n-(4-methylbenzoyl)-, ethyl ester. «beta»-Alanine, N-(4-butylbenzoyl)-, propyl ester. «beta»-Alanine, N-(4-ethylbenzoyl)-, isohexyl ester. «beta»-Alanine, N-(4-butylbenzoyl)-, butyl ester. «beta»-Alanine, N-(4-butylbenzoyl)-, isobutyl ester.

Find more compounds similar to «beta»-Alanine, N-(4-ethylbenzoyl)-, ethyl ester.

Sources

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