Chemical Properties of D-Alanine, N-(2,5-difluorobenzoyl)-, eicosyl ester

D-Alanine, N-(2,5-difluorobenzoyl)-, eicosyl ester

InChI
InChI=1S/C30H49F2NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23-36-30(35)25(2)33-29(34)27-24-26(31)21-22-28(27)32/h21-22,24-25H,3-20,23H2,1-2H3,(H,33,34)
InChI Key
VIBJOAHWKGKOQL-UHFFFAOYSA-N
Formula
C30H49F2NO3
SMILES
CCCCCCCCCCCCCCCCCCCCOC(=O)C(C)NC(=O)c1cc(F)ccc1F
Molecular Weight1
509.72
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Physical Properties

Property Value Unit Source
ΔfusH° 80.42 kJ/mol Joback Calculated Property
log10WS -8.75 Relay (1.0) Calculated Property
logPoct/wat 8.668 Crippen Calculated Property
McVol 432.330 ml/mol McGowan Calculated Property
Pc 693.25 kPa Joback Calculated Property
Inp [3532.00; 3532.00]   Show Hide
Inp 3532.00 NIST
Inp 3532.00 NIST
Tboil 695.64 K Relay (1.0) Calculated Property
Tfus 362.19 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, 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 [1532.94; 1618.59] J/mol×K [1083.00; 1352.39] Show Hide
Cp,gas 1532.94 J/mol×K 1083.00 Joback Calculated Property
Cp,gas 1552.16 J/mol×K 1127.90 Joback Calculated Property
Cp,gas 1569.21 J/mol×K 1172.80 Joback Calculated Property
Cp,gas 1584.22 J/mol×K 1217.70 Joback Calculated Property
Cp,gas 1597.36 J/mol×K 1262.59 Joback Calculated Property
Cp,gas 1608.76 J/mol×K 1307.49 Joback Calculated Property
Cp,gas 1618.59 J/mol×K 1352.39 Joback Calculated Property

Similar Compounds

D-Alanine, N-(2,5-difluorobenzoyl)-, dodecyl ester. D-Alanine, N-(2,5-difluorobenzoyl)-, heptadecyl ester. D-Alanine, N-(2,5-difluorobenzoyl)-, tetradecyl ester. D-Alanine, N-(2,5-difluorobenzoyl)-, octadecyl ester. D-Alanine, N-(2,5-difluorobenzoyl)-, tridecyl ester. D-Alanine, N-(2,5-difluorobenzoyl)-, decyl ester. D-Alanine, N-(2,5-difluorobenzoyl)-, pentadecyl ester. D-Alanine, N-(2,5-difluorobenzoyl)-, nonadecyl ester. D-Alanine, N-(2,5-difluorobenzoyl)-, undecyl ester. D-Alanine, N-(2,5-difluorobenzoyl)-, hexadecyl ester. D-Alanine, N-(2,5-difluorobenzoyl)-, pentyl ester. D-alanine, n-(2,4-difluorobenzoyl)-, eicosyl ester. D-Alanine, N-(2,4-difluorobenzoyl)-, heptadecyl ester. D-Alanine, N-(2,4-difluorobenzoyl)-, octadecyl ester. D-Alanine, N-(2,4-difluorobenzoyl)-, nonadecyl ester.

Find more compounds similar to D-Alanine, N-(2,5-difluorobenzoyl)-, eicosyl ester.

Sources

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