Chemical Properties of Sarcosine, N-(3-fluorobenzoyl)-, pentadecyl ester

Sarcosine, N-(3-fluorobenzoyl)-, pentadecyl ester

InChI
InChI=1S/C25H40FNO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-30-24(28)21-27(2)25(29)22-17-16-18-23(26)20-22/h16-18,20H,3-15,19,21H2,1-2H3
InChI Key
KATLLCTYWBNWOV-UHFFFAOYSA-N
Formula
C25H40FNO3
SMILES
CCCCCCCCCCCCCCCOC(=O)CN(C)C(=O)c1cccc(F)c1
Molecular Weight1
421.60
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Physical Properties

Property Value Unit Source
ΔfusH° 66.23 kJ/mol Joback Calculated Property
IE 8.95 eV Relay (1.0) Calculated Property
log10WS -6.89 Relay (1.0) Calculated Property
logPoct/wat 6.532 Crippen Calculated Property
McVol 360.110 ml/mol McGowan Calculated Property
Pc 928.94 kPa Joback Calculated Property
Tboil 677.40 K Relay (1.0) Calculated Property
Tfus 307.67 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 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.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [522.09; 1229.77] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-1.12750e+01
Coefficient B2.29334e+00
Coefficient C-1.31606e-03
Coefficient D2.63760e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 522.09 J/mol×K 273.00 Calculated Property
Cp,gas 647.02 J/mol×K 353.78 Calculated Property
Cp,gas 758.43 J/mol×K 434.56 Calculated Property
Cp,gas 857.15 J/mol×K 515.33 Calculated Property
Cp,gas 944.02 J/mol×K 596.11 Calculated Property
Cp,gas 1019.87 J/mol×K 676.89 Calculated Property
Cp,gas 1085.54 J/mol×K 757.67 Calculated Property
Cp,gas 1141.85 J/mol×K 838.44 Calculated Property
Cp,gas 1189.65 J/mol×K 919.22 Calculated Property
Cp,gas 1229.77 J/mol×K 1000.00 Calculated Property

Similar Compounds

Sarcosine, N-(3-fluorobenzoyl)-, decyl ester. Sarcosine, N-(3-fluorobenzoyl)-, hexadecyl ester. Sarcosine, n-(3-fluorobenzoyl)-, tetradecyl ester. Sarcosine, N-(3-fluorobenzoyl)-, nonyl ester. Sarcosine, N-(3-fluorobenzoyl)-, undecyl ester. Sarcosine, N-(3-fluorobenzoyl)-, octyl ester. Sarcosine, N-(3-fluorobenzoyl)-, dodecyl ester. Sarcosine, N-(3-fluorobenzoyl)-, heptyl ester. Sarcosine, n-(3-fluorobenzoyl)-, hexyl ester. Sarcosine, N-(3-fluorobenzoyl)-, pentyl ester. Sarcosine, N-(2-fluorobenzoyl)-, nonyl ester. Sarcosine, N-(2-fluorobenzoyl)-, octyl ester. Sarcosine, N-(2-fluorobenzoyl)-, undecyl ester. Sarcosine, N-(2-fluorobenzoyl)-, dodecyl ester. Sarcosine, N-(2-fluorobenzoyl)-, pentadecyl ester.

Find more compounds similar to Sarcosine, N-(3-fluorobenzoyl)-, pentadecyl ester.

Sources

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