Chemical Properties of D-Alanine, N-(2,4-difluorobenzoyl)-, butyl ester

D-Alanine, N-(2,4-difluorobenzoyl)-, butyl ester

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InChI
InChI=1S/C14H17F2NO3/c1-3-4-7-20-14(19)9(2)17-13(18)11-6-5-10(15)8-12(11)16/h5-6,8-9H,3-4,7H2,1-2H3,(H,17,18)
InChI Key
BWRIFFQTVGJBJD-UHFFFAOYSA-N
Formula
C14H17F2NO3
SMILES
CCCCOC(=O)C(C)NC(=O)c1ccc(F)cc1F
Molecular Weight1
285.29
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Physical Properties

Property Value Unit Source
Δf -505.36 kJ/mol Joback Calculated Property
Δfgas -820.11 kJ/mol Joback Calculated Property
Δfus 37.40 kJ/mol Joback Calculated Property
Δvap 70.67 kJ/mol Joback Calculated Property
log10WS -3.97 Crippen Calculated Property
logPoct/wat 2.426 Crippen Calculated Property
McVol 206.890 ml/mol McGowan Calculated Property
Pc 2027.23 kPa Joback Calculated Property
Inp [1876.00; 1876.00]   Show Hide
Inp 1876.00 NIST
Inp 1876.00 NIST
Tboil 734.79 K Joback Calculated Property
Tc 932.26 K Joback Calculated Property
Tfus 459.93 K Joback Calculated Property
Vc 0.806 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [582.27; 648.75] J/mol×K [734.79; 932.26] Show Hide
Cp,gas 582.27 J/mol×K 734.79 Joback Calculated Property
Cp,gas 595.40 J/mol×K 767.70 Joback Calculated Property
Cp,gas 607.68 J/mol×K 800.61 Joback Calculated Property
Cp,gas 619.14 J/mol×K 833.53 Joback Calculated Property
Cp,gas 629.80 J/mol×K 866.44 Joback Calculated Property
Cp,gas 639.66 J/mol×K 899.35 Joback Calculated Property
Cp,gas 648.75 J/mol×K 932.26 Joback Calculated Property

Similar Compounds

D-Alanine, N-(2,4-difluorobenzoyl)-, pentyl ester. D-Alanine, N-(2,4-difluorobenzoyl)-, hexadecyl ester. D-Alanine, N-(2,4-difluorobenzoyl)-, octadecyl ester. D-Alanine, N-(2,4-difluorobenzoyl)-, eicosyl ester. D-Alanine, N-(2,4-difluorobenzoyl)-, heptadecyl ester. D-Alanine, N-(2,4-difluorobenzoyl)-, nonadecyl ester. D-Alanine, N-(2,4-difluorobenzoyl)-, propyl ester. D-Alanine, N-(2,4-difluorobenzoyl)-, isohexyl ester. D-Alanine, N-(3,4-difluorobenzoyl)-, butyl ester. D-Alanine, N-(2,4-difluorobenzoyl)-, ethyl ester. D-Alanine, N-(3,4-difluorobenzoyl)-, pentyl ester. D-Alanine, N-(2,5-difluorobenzoyl)-, pentyl ester. D-Alanine, N-(3,4-difluorobenzoyl)-, octyl ester. D-Alanine, N-(3,4-difluorobenzoyl)-, undecyl ester. D-Alanine, N-(3,4-difluorobenzoyl)-, eicosyl ester.

Find more compounds similar to D-Alanine, N-(2,4-difluorobenzoyl)-, butyl ester.

Sources

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