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

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

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InChI
InChI=1S/C13H13F4NO3/c1-3-21-12(20)7(2)18-11(19)8-4-5-9(10(14)6-8)13(15,16)17/h4-7H,3H2,1-2H3,(H,18,19)
InChI Key
LQEPWMNNUGKCFT-UHFFFAOYSA-N
Formula
C13H13F4NO3
SMILES
CCOC(=O)C(C)NC(=O)c1ccc(C(F)(F)F)c(F)c1
Molecular Weight1
307.24
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Physical Properties

Property Value Unit Source
Δf -900.56 kJ/mol Joback Calculated Property
Δfgas -1200.44 kJ/mol Joback Calculated Property
Δfus 33.56 kJ/mol Joback Calculated Property
Δvap 65.52 kJ/mol Joback Calculated Property
log10WS -3.90 Crippen Calculated Property
logPoct/wat 2.526 Crippen Calculated Property
McVol 196.340 ml/mol McGowan Calculated Property
Pc 2073.65 kPa Joback Calculated Property
Inp 1710.00 NIST
Tboil 707.22 K Joback Calculated Property
Tc 900.82 K Joback Calculated Property
Tfus 452.26 K Joback Calculated Property
Vc 0.775 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [547.77; 607.87] J/mol×K [707.22; 900.82] Show Hide
Cp,gas 547.77 J/mol×K 707.22 Joback Calculated Property
Cp,gas 559.70 J/mol×K 739.49 Joback Calculated Property
Cp,gas 570.82 J/mol×K 771.75 Joback Calculated Property
Cp,gas 581.17 J/mol×K 804.02 Joback Calculated Property
Cp,gas 590.78 J/mol×K 836.29 Joback Calculated Property
Cp,gas 599.67 J/mol×K 868.55 Joback Calculated Property
Cp,gas 607.87 J/mol×K 900.82 Joback Calculated Property

Similar Compounds

D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, propyl ester. D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, isobutyl ester. D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, pentyl ester. D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, octyl ester. D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, heptyl ester. D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, undecyl ester. D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, nonyl ester. D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, octadecyl ester. D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, heptadecyl ester. D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, dodecyl ester. D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, hexadecyl ester. D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, nonadecyl ester. D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, eicosyl ester. D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, decyl ester. D-Alanine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, tridecyl ester.

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

Sources

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