Chemical Properties of D-Alanine, N-(2-fluoro-6-trifluoromethylbenzoyl)-, tridecyl ester

D-Alanine, N-(2-fluoro-6-trifluoromethylbenzoyl)-, tridecyl ester

InChI
InChI=1S/C24H35F4NO3/c1-3-4-5-6-7-8-9-10-11-12-13-17-32-23(31)18(2)29-22(30)21-19(24(26,27)28)15-14-16-20(21)25/h14-16,18H,3-13,17H2,1-2H3,(H,29,30)
InChI Key
RABKQVKODCSMEV-UHFFFAOYSA-N
Formula
C24H35F4NO3
SMILES
CCCCCCCCCCCCCOC(=O)C(C)NC(=O)c1c(F)cccc1C(F)(F)F
Molecular Weight1
461.53
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Physical Properties

Property Value Unit Source
ΔfusH° 63.63 kJ/mol Joback Calculated Property
logPoct/wat 6.817 Crippen Calculated Property
McVol 351.330 ml/mol McGowan Calculated Property
Inp [2803.00; 2803.00]   Show Hide
Inp 2803.00 NIST
Inp 2803.00 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [526.92; 1197.21] 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 A5.53200e+00
Coefficient B2.25824e+00
Coefficient C-1.35482e-03
Coefficient D2.88260e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 526.92 J/mol×K 273.00 Calculated Property
Cp,gas 647.64 J/mol×K 353.78 Calculated Property
Cp,gas 754.68 J/mol×K 434.56 Calculated Property
Cp,gas 848.93 J/mol×K 515.33 Calculated Property
Cp,gas 931.32 J/mol×K 596.11 Calculated Property
Cp,gas 1002.76 J/mol×K 676.89 Calculated Property
Cp,gas 1064.16 J/mol×K 757.67 Calculated Property
Cp,gas 1116.42 J/mol×K 838.44 Calculated Property
Cp,gas 1160.47 J/mol×K 919.22 Calculated Property
Cp,gas 1197.21 J/mol×K 1000.00 Calculated Property

Similar Compounds

D-Alanine, N-(2-fluoro-6-trifluoromethylbenzoyl)-, nonadecyl ester. D-Alanine, N-(2-fluoro-6-trifluoromethylbenzoyl)-, undecyl ester. D-Alanine, N-(2-fluoro-6-trifluoromethylbenzoyl)-, decyl ester. D-Alanine, N-(2-fluoro-6-trifluoromethylbenzoyl)-, nonyl ester. D-Alanine, N-(2-fluoro-6-trifluoromethylbenzoyl)-, octadecyl ester. D-Alanine, N-(2-fluoro-6-trifluoromethylbenzoyl)-, eicosyl ester. D-Alanine, N-(2-fluoro-6-trifluoromethylbenzoyl)-, hexadecyl ester. D-Alanine, N-(2-fluoro-6-trifluoromethylbenzoyl)-, dodecyl ester. D-Alanine, N-(2-fluoro-6-trifluoromethylbenzoyl)-, heptadecyl ester. D-Alanine, N-(2-fluoro-6-trifluoromethylbenzoyl)-, pentadecyl ester. D-Alanine, N-(2-fluoro-6-trifluoromethylbenzoyl)-, tetradecyl ester. D-Alanine, N-(2-fluoro-6-trifluoromethylbenzoyl)-, isohexyl ester. D-Alanine, N-(5-fluoro-2-trifluoromethylbenzoyl)-, undecyl ester. D-Alanine, N-(5-fluoro-2-trifluoromethylbenzoyl)-, octadecyl ester. D-Alanine, N-(5-fluoro-2-trifluoromethylbenzoyl)-, nonadecyl ester.

Find more compounds similar to D-Alanine, N-(2-fluoro-6-trifluoromethylbenzoyl)-, tridecyl ester.

Sources

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