Chemical Properties of «beta»-Alanine, N-(3-fluorobenzoyl)-, pentyl ester

«beta»-Alanine, N-(3-fluorobenzoyl)-, pentyl ester

InChI
InChI=1S/C15H20FNO3/c1-2-3-4-10-20-14(18)8-9-17-15(19)12-6-5-7-13(16)11-12/h5-7,11H,2-4,8-10H2,1H3,(H,17,19)
InChI Key
SYIXGCNYBMGTIP-UHFFFAOYSA-N
Formula
C15H20FNO3
SMILES
CCCCCOC(=O)CCNC(=O)c1cccc(F)c1
Molecular Weight1
281.32
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Physical Properties

Property Value Unit Source
ΔfusH° 42.40 kJ/mol Joback Calculated Property
ΔvapH° 94.53 kJ/mol Relay (1.0) Calculated Property
IE 9.12 eV Relay (1.0) Calculated Property
log10WS -3.96 Relay (1.0) Calculated Property
logPoct/wat 2.679 Crippen Calculated Property
McVol 219.210 ml/mol McGowan Calculated Property
Pc 1880.53 kPa Joback Calculated Property
Inp 2137.00 NIST
Tboil 613.90 K Relay (1.0) Calculated Property
Tfus 301.51 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor 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 [624.30; 695.44] J/mol×K [735.99; 932.87] Show Hide
Cp,gas 624.30 J/mol×K 735.99 Joback Calculated Property
Cp,gas 638.42 J/mol×K 768.80 Joback Calculated Property
Cp,gas 651.61 J/mol×K 801.62 Joback Calculated Property
Cp,gas 663.87 J/mol×K 834.43 Joback Calculated Property
Cp,gas 675.25 J/mol×K 867.24 Joback Calculated Property
Cp,gas 685.76 J/mol×K 900.06 Joback Calculated Property
Cp,gas 695.44 J/mol×K 932.87 Joback Calculated Property

Similar Compounds

«beta»-Alanine, N-(3-fluorobenzoyl)-, hexyl ester. «beta»-Alanine, N-(3-fluorobenzoyl)-, undecyl ester. .beta.-Alanine, N-(3-fluorobenzoyl)-, tetradecyl ester. «beta»-Alanine, N-(3-fluorobenzoyl)-, nonyl ester. «beta»-Alanine, N-(3-fluorobenzoyl)-, pentadecyl ester. .beta.-Alanine, N-(3-fluorobenzoyl)-, decyl ester. .beta.-Alanine, N-(3-fluorobenzoyl)-, heptyl ester. «beta»-Alanine, N-(3-fluorobenzoyl)-, octyl ester. «beta»-Alanine, N-(3-fluorobenzoyl)-, butyl ester. «beta»-Alanine, N-(4-fluorobenzoyl)-, pentyl ester. .beta.-Alanine, N-(4-fluorobenzoyl)-, hexyl ester. «beta»-Alanine, N-(3-fluorobenzoyl)-, propyl ester. .beta.-Alanine, N-(4-fluorobenzoyl)-, pentadecyl ester. «beta»-Alanine, N-(4-fluorobenzoyl)-, decyl ester. .BETA.-alanine, n-(4-fluorobenzoyl)-, octyl ester.

Find more compounds similar to «beta»-Alanine, N-(3-fluorobenzoyl)-, pentyl ester.

Sources

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