Chemical Properties of D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, isobutyl ester

D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, isobutyl ester

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InChI
InChI=1S/C15H17F4NO3/c1-8(2)7-23-14(22)9(3)20-13(21)10-4-5-11(12(16)6-10)15(17,18)19/h4-6,8-9H,7H2,1-3H3,(H,20,21)
InChI Key
MDTYWOPFMBKXLL-UHFFFAOYSA-N
Formula
C15H17F4NO3
SMILES
CC(C)COC(=O)C(C)NC(=O)c1ccc(C(F)(F)F)c(F)c1
Molecular Weight1
335.29
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Physical Properties

Property Value Unit Source
Δf -886.16 kJ/mol Joback Calculated Property
Δfgas -1247.00 kJ/mol Joback Calculated Property
Δfus 35.21 kJ/mol Joback Calculated Property
Δvap 69.58 kJ/mol Joback Calculated Property
log10WS -4.50 Crippen Calculated Property
logPoct/wat 3.162 Crippen Calculated Property
McVol 224.520 ml/mol McGowan Calculated Property
Pc 1765.41 kPa Joback Calculated Property
Inp [1858.00; 1858.00]   Show Hide
Inp 1858.00 NIST
Inp 1858.00 NIST
Tboil 752.54 K Joback Calculated Property
Tc 946.57 K Joback Calculated Property
Tfus 459.80 K Joback Calculated Property
Vc 0.881 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [654.74; 719.75] J/mol×K [752.54; 946.57] Show Hide
Cp,gas 654.74 J/mol×K 752.54 Joback Calculated Property
Cp,gas 667.67 J/mol×K 784.88 Joback Calculated Property
Cp,gas 679.72 J/mol×K 817.22 Joback Calculated Property
Cp,gas 690.91 J/mol×K 849.55 Joback Calculated Property
Cp,gas 701.29 J/mol×K 881.89 Joback Calculated Property
Cp,gas 710.89 J/mol×K 914.23 Joback Calculated Property
Cp,gas 719.75 J/mol×K 946.57 Joback Calculated Property

Similar Compounds

D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, propyl ester. D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, ethyl ester. D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, isohexyl ester. D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, pentyl ester. D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, nonadecyl ester. D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, undecyl ester. D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, octadecyl ester. D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, hexadecyl ester. D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, octyl ester. D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, pentadecyl ester. D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, tetradecyl ester. D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, heptyl ester. D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, nonyl ester. D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, decyl ester. D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, heptadecyl ester.

Find more compounds similar to D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, isobutyl ester.

Sources

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