Chemical Properties of .beta.-Alanine, N-(3-fluorobenzoyl)-, heptyl ester

.beta.-Alanine, N-(3-fluorobenzoyl)-, heptyl ester

InChI
InChI=1S/C17H24FNO3/c1-2-3-4-5-6-12-22-16(20)10-11-19-17(21)14-8-7-9-15(18)13-14/h7-9,13H,2-6,10-12H2,1H3,(H,19,21)
InChI Key
HBICTNOIJPGLBT-UHFFFAOYSA-N
Formula
C17H24FNO3
SMILES
CCCCCCCOC(=O)CCNC(=O)c1cccc(F)c1
Molecular Weight1
309.38
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Physical Properties

Property Value Unit Source
ΔfusH° 47.59 kJ/mol Joback Calculated Property
ΔvapH° 101.69 kJ/mol Relay (1.0) Calculated Property
log10WS -4.74 Relay (1.0) Calculated Property
logPoct/wat 3.459 Crippen Calculated Property
McVol 247.390 ml/mol McGowan Calculated Property
Pc 1602.56 kPa Joback Calculated Property
Inp 2343.00 NIST
Tboil 629.92 K Relay (1.0) Calculated Property
Tfus 304.86 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, 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 [735.33; 809.33] J/mol×K [781.75; 977.02] Show Hide
Cp,gas 735.33 J/mol×K 781.75 Joback Calculated Property
Cp,gas 750.06 J/mol×K 814.29 Joback Calculated Property
Cp,gas 763.79 J/mol×K 846.84 Joback Calculated Property
Cp,gas 776.55 J/mol×K 879.38 Joback Calculated Property
Cp,gas 788.38 J/mol×K 911.93 Joback Calculated Property
Cp,gas 799.29 J/mol×K 944.47 Joback Calculated Property
Cp,gas 809.33 J/mol×K 977.02 Joback Calculated Property

Similar Compounds

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

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

Sources

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