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

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

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InChI
InChI=1S/C17H21F4NO3/c1-10(2)6-5-9-25-16(24)11(3)22-15(23)14-12(17(19,20)21)7-4-8-13(14)18/h4,7-8,10-11H,5-6,9H2,1-3H3,(H,22,23)
InChI Key
ITBRKVCKJQYSQV-UHFFFAOYSA-N
Formula
C17H21F4NO3
SMILES
CC(C)CCCOC(=O)C(C)NC(=O)c1c(F)cccc1C(F)(F)F
Molecular Weight1
363.35

Physical Properties

Property Value Unit Source
Δf -869.32 kJ/mol Joback Calculated Property
Δfgas -1288.28 kJ/mol Joback Calculated Property
Δfus 40.39 kJ/mol Joback Calculated Property
Δvap 74.03 kJ/mol Joback Calculated Property
log10WS -5.33 Crippen Calculated Property
logPoct/wat 3.942 Crippen Calculated Property
McVol 252.700 ml/mol McGowan Calculated Property
Pc 1511.67 kPa Joback Calculated Property
Inp [2068.00; 2068.00]   Show Hide
Inp 2068.00 NIST
Inp 2068.00 NIST
Tboil 798.30 K Joback Calculated Property
Tc 991.98 K Joback Calculated Property
Tfus 482.34 K Joback Calculated Property
Vc 0.994 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [765.41; 833.82] J/mol×K [798.30; 991.98] Show Hide
Cp,gas 765.41 J/mol×K 798.30 Joback Calculated Property
Cp,gas 779.02 J/mol×K 830.58 Joback Calculated Property
Cp,gas 791.69 J/mol×K 862.86 Joback Calculated Property
Cp,gas 803.47 J/mol×K 895.14 Joback Calculated Property
Cp,gas 814.39 J/mol×K 927.42 Joback Calculated Property
Cp,gas 824.50 J/mol×K 959.70 Joback Calculated Property
Cp,gas 833.82 J/mol×K 991.98 Joback Calculated Property

Similar Compounds

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

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

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