Chemical Properties of D-Alanine, N-(2,5-ditrifluoromethylbenzoyl)-, octyl ester

D-Alanine, N-(2,5-ditrifluoromethylbenzoyl)-, octyl ester

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InChI
InChI=1S/C20H25F6NO3/c1-3-4-5-6-7-8-11-30-18(29)13(2)27-17(28)15-12-14(19(21,22)23)9-10-16(15)20(24,25)26/h9-10,12-13H,3-8,11H2,1-2H3,(H,27,28)
InChI Key
LESOGZVKAKFFCK-UHFFFAOYSA-N
Formula
C20H25F6NO3
SMILES
CCCCCCCCOC(=O)C(C)NC(=O)c1cc(C(F)(F)F)ccc1C(F)(F)F
Molecular Weight1
441.41
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Physical Properties

Property Value Unit Source
Δf -1228.40 kJ/mol Joback Calculated Property
Δfgas -1745.89 kJ/mol Joback Calculated Property
Δfus 50.43 kJ/mol Joback Calculated Property
Δvap 78.17 kJ/mol Joback Calculated Property
log10WS -7.18 Crippen Calculated Property
logPoct/wat 5.746 Crippen Calculated Property
McVol 298.510 ml/mol McGowan Calculated Property
Pc 1157.71 kPa Joback Calculated Property
Inp 2135.00 NIST
Tboil 862.69 K Joback Calculated Property
Tc 1057.83 K Joback Calculated Property
Tfus 534.75 K Joback Calculated Property
Vc 1.192 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [953.18; 1023.76] J/mol×K [862.69; 1057.83] Show Hide
Cp,gas 953.18 J/mol×K 862.69 Joback Calculated Property
Cp,gas 967.14 J/mol×K 895.21 Joback Calculated Property
Cp,gas 980.13 J/mol×K 927.74 Joback Calculated Property
Cp,gas 992.22 J/mol×K 960.26 Joback Calculated Property
Cp,gas 1003.48 J/mol×K 992.79 Joback Calculated Property
Cp,gas 1013.97 J/mol×K 1025.31 Joback Calculated Property
Cp,gas 1023.76 J/mol×K 1057.83 Joback Calculated Property

Similar Compounds

D-Alanine, N-(2,5-ditrifluoromethylbenzoyl)-, hexyl ester. D-Alanine, N-(2,5-ditrifluoromethylbenzoyl)-, hexadecyl ester. D-Alanine, N-(2,5-ditrifluoromethylbenzoyl)-, heptyl ester. D-Alanine, N-(2,5-ditrifluoromethylbenzoyl)-, nonyl ester. D-Alanine, N-(2,5-ditrifluoromethylbenzoyl)-, octadecyl ester. D-Alanine, N-(2,5-ditrifluoromethylbenzoyl)-, decyl ester. D-Alanine, N-(2,5-ditrifluoromethylbenzoyl)-, pentyl ester. D-Alanine, N-(2,5-ditrifluoromethylbenzoyl)-, butyl ester. D-Alanine, N-(2,5-ditrifluoromethylbenzoyl)-, propyl ester. D-Alanine, N-(5-fluoro-2-trifluoromethylbenzoyl)-, heptadecyl ester. D-Alanine, N-(5-fluoro-2-trifluoromethylbenzoyl)-, heptyl ester. D-Alanine, N-(5-fluoro-2-trifluoromethylbenzoyl)-, octyl ester. D-Alanine, N-(5-fluoro-2-trifluoromethylbenzoyl)-, octadecyl ester. D-Alanine, N-(5-fluoro-2-trifluoromethylbenzoyl)-, hexadecyl ester. D-Alanine, N-(5-fluoro-2-trifluoromethylbenzoyl)-, decyl ester.

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

Sources

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