Chemical Properties of Sarcosine, N-(4-trifluoromethylbenzoyl)-, heptyl ester

Sarcosine, N-(4-trifluoromethylbenzoyl)-, heptyl ester

InChI
InChI=1S/C18H24F3NO3/c1-3-4-5-6-7-12-25-16(23)13-22(2)17(24)14-8-10-15(11-9-14)18(19,20)21/h8-11H,3-7,12-13H2,1-2H3
InChI Key
JQJWZMZOGUYDAZ-UHFFFAOYSA-N
Formula
C18H24F3NO3
SMILES
CCCCCCCOC(=O)CN(C)C(=O)c1ccc(C(F)(F)F)cc1
Molecular Weight1
359.39
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Physical Properties

Property Value Unit Source
ΔfusH° 46.84 kJ/mol Joback Calculated Property
ΔvapH° 92.88 kJ/mol Relay (1.0) Calculated Property
log10WS -4.89 Relay (1.0) Calculated Property
logPoct/wat 4.291 Crippen Calculated Property
McVol 265.020 ml/mol McGowan Calculated Property
Pc 1392.29 kPa Joback Calculated Property
Inp 2188.00 NIST
Tboil 625.10 K Relay (1.0) Calculated Property
Tfus 329.49 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.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [388.53; 884.24] 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-1.72030e+01
Coefficient B1.77774e+00
Coefficient C-1.13986e-03
Coefficient D2.63560e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 388.53 J/mol×K 273.00 Calculated Property
Cp,gas 480.73 J/mol×K 353.78 Calculated Property
Cp,gas 561.70 J/mol×K 434.56 Calculated Property
Cp,gas 632.28 J/mol×K 515.33 Calculated Property
Cp,gas 693.31 J/mol×K 596.11 Calculated Property
Cp,gas 745.61 J/mol×K 676.89 Calculated Property
Cp,gas 790.02 J/mol×K 757.67 Calculated Property
Cp,gas 827.37 J/mol×K 838.44 Calculated Property
Cp,gas 858.50 J/mol×K 919.22 Calculated Property
Cp,gas 884.24 J/mol×K 1000.00 Calculated Property

Similar Compounds

Sarcosine, N-(4-trifluoromethylbenzoyl)-, tetradecyl ester. Sarcosine, N-(4-trifluoromethylbenzoyl)-, octyl ester. Sarcosine, N-(4-trifluoromethylbenzoyl)-, undecyl ester. Sarcosine, N-(4-trifluoromethylbenzoyl)-, hexadecyl ester. Sarcosine, N-(4-trifluoromethylbenzoyl)-, dodecyl ester. Sarcosine, N-(4-trifluoromethylbenzoyl)-, decyl ester. Sarcosine, N-(4-trifluoromethylbenzoyl)-, pentadecyl ester. Sarcosine, N-(4-trifluoromethylbenzoyl)-, heptadecyl ester. Sarcosine, N-(4-trifluoromethylbenzoyl)-, nonyl ester. Sarcosine, N-(4-trifluoromethylbenzoyl)-, pentyl ester. Sarcosine, N-(4-trifluoromethylbenzoyl)-, isohexyl ester. Sarcosine, N-(4-trifluoromethylbenzoyl)-, butyl ester. Sarcosine, N-(4-methylbenzoyl)-, nonyl ester. Sarcosine, N-(4-methylbenzoyl)-, octyl ester. Sarcosine, N-(4-methylbenzoyl)-, tetradecyl ester.

Find more compounds similar to Sarcosine, N-(4-trifluoromethylbenzoyl)-, heptyl ester.

Sources

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