Chemical Properties of D-Alanine, N-(2-fluoro-3-trifluoromethylbenzoyl)-, dodecyl ester

D-Alanine, N-(2-fluoro-3-trifluoromethylbenzoyl)-, dodecyl ester

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InChI
InChI=1S/C23H33F4NO3/c1-3-4-5-6-7-8-9-10-11-12-16-31-22(30)17(2)28-21(29)18-14-13-15-19(20(18)24)23(25,26)27/h13-15,17H,3-12,16H2,1-2H3,(H,28,29)
InChI Key
ZAXKSMPMMQUKJQ-UHFFFAOYSA-N
Formula
C23H33F4NO3
SMILES
CCCCCCCCCCCCOC(=O)C(C)NC(=O)c1cccc(C(F)(F)F)c1F
Molecular Weight1
447.51
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Physical Properties

Property Value Unit Source
Δf -816.36 kJ/mol Joback Calculated Property
Δfgas -1406.84 kJ/mol Joback Calculated Property
Δfus 59.46 kJ/mol Joback Calculated Property
Δvap 87.78 kJ/mol Joback Calculated Property
log10WS -8.09 Crippen Calculated Property
logPoct/wat 6.427 Crippen Calculated Property
McVol 337.240 ml/mol McGowan Calculated Property
Pc 1003.98 kPa Joback Calculated Property
Inp [2658.00; 2658.00]   Show Hide
Inp 2658.00 NIST
Inp 2658.00 NIST
Tboil 936.02 K Joback Calculated Property
Tc 1146.12 K Joback Calculated Property
Tfus 564.96 K Joback Calculated Property
Vc 1.335 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1117.18; 1195.31] J/mol×K [936.02; 1146.12] Show Hide
Cp,gas 1117.18 J/mol×K 936.02 Joback Calculated Property
Cp,gas 1132.91 J/mol×K 971.04 Joback Calculated Property
Cp,gas 1147.47 J/mol×K 1006.05 Joback Calculated Property
Cp,gas 1160.92 J/mol×K 1041.07 Joback Calculated Property
Cp,gas 1173.33 J/mol×K 1076.09 Joback Calculated Property
Cp,gas 1184.77 J/mol×K 1111.10 Joback Calculated Property
Cp,gas 1195.31 J/mol×K 1146.12 Joback Calculated Property

Similar Compounds

D-Alanine, N-(2-fluoro-3-trifluoromethylbenzoyl)-, nonyl ester. D-Alanine, N-(2-fluoro-3-trifluoromethylbenzoyl)-, octyl ester. D-Alanine, N-(2-fluoro-3-trifluoromethylbenzoyl)-, tridecyl ester. D-Alanine, N-(2-fluoro-3-trifluoromethylbenzoyl)-, eicosyl ester. D-Alanine, N-(2-fluoro-3-trifluoromethylbenzoyl)-, decyl ester. D-Alanine, N-(2-fluoro-3-trifluoromethylbenzoyl)-, undecyl ester. D-Alanine, N-(2-fluoro-3-trifluoromethylbenzoyl)-, hexadecyl ester. D-Alanine, N-(2-fluoro-3-trifluoromethylbenzoyl)-, pentadecyl ester. D-Alanine, N-(2-fluoro-3-trifluoromethylbenzoyl)-, octadecyl ester. D-Alanine, N-(2-fluoro-3-trifluoromethylbenzoyl)-, heptadecyl ester. D-Alanine, N-(2-fluoro-3-trifluoromethylbenzoyl)-, tetradecyl ester. D-Alanine, N-(2-fluoro-3-trifluoromethylbenzoyl)-, nonadecyl ester. D-Alanine, N-(2-fluoro-5-trifluoromethylbenzoyl)-, nonyl ester. D-Alanine, N-(2-fluoro-5-trifluoromethylbenzoyl)-, tetradecyl ester. D-Alanine, N-(2-fluoro-5-trifluoromethylbenzoyl)-, nonadecyl ester.

Find more compounds similar to D-Alanine, N-(2-fluoro-3-trifluoromethylbenzoyl)-, dodecyl ester.

Sources

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