Chemical Properties of L-Valine, N-(5-fluoro-2-trifluoromethyl)-, octadecyl ester

L-Valine, N-(5-fluoro-2-trifluoromethyl)-, octadecyl ester

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InChI
InChI=1S/C31H49F4NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-39-30(38)28(24(2)3)36-29(37)26-23-25(32)20-21-27(26)31(33,34)35/h20-21,23-24,28H,4-19,22H2,1-3H3,(H,36,37)
InChI Key
XKZWYJAYBYIJNH-UHFFFAOYSA-N
Formula
C31H49F4NO3
SMILES
CCCCCCCCCCCCCCCCCCOC(=O)C(NC(=O)c1cc(F)ccc1C(F)(F)F)C(C)C
Molecular Weight1
559.72
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Physical Properties

Property Value Unit Source
Δf -751.44 kJ/mol Joback Calculated Property
Δfgas -1577.24 kJ/mol Joback Calculated Property
Δfus 76.65 kJ/mol Joback Calculated Property
Δvap 105.20 kJ/mol Joback Calculated Property
log10WS -11.19 Crippen Calculated Property
logPoct/wat 9.404 Crippen Calculated Property
McVol 449.960 ml/mol McGowan Calculated Property
Pc 652.10 kPa Joback Calculated Property
Inp [3355.00; 3355.00]   Show Hide
Inp 3355.00 NIST
Inp 3355.00 NIST
Tboil 1118.62 K Joback Calculated Property
Tc 1410.90 K Joback Calculated Property
Tfus 640.12 K Joback Calculated Property
Vc 1.778 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1618.91; 1718.07] J/mol×K [1118.62; 1410.90] Show Hide
Cp,gas 1618.91 J/mol×K 1118.62 Joback Calculated Property
Cp,gas 1639.67 J/mol×K 1167.33 Joback Calculated Property
Cp,gas 1658.40 J/mol×K 1216.05 Joback Calculated Property
Cp,gas 1675.35 J/mol×K 1264.76 Joback Calculated Property
Cp,gas 1690.78 J/mol×K 1313.47 Joback Calculated Property
Cp,gas 1704.93 J/mol×K 1362.18 Joback Calculated Property
Cp,gas 1718.07 J/mol×K 1410.90 Joback Calculated Property

Similar Compounds

L-Valine, N-(5-fluoro-2-trifluoromethyl)-, tetradecyl ester. L-Valine, N-(5-fluoro-2-trifluoromethyl)-, pentadecyl ester. L-Valine, N-(5-fluoro-2-trifluoromethyl)-, undecyl ester. L-Valine, N-(5-fluoro-2-trifluoromethyl)-, hexadecyl ester. L-Valine, N-(5-fluoro-2-trifluoromethyl)-, hexyl ester. L-Valine, N-(5-fluoro-2-trifluoromethyl)-, dodecyl ester. L-Valine, N-(5-fluoro-2-trifluoromethyl)-, heptadecyl ester. L-Valine, N-(5-fluoro-2-trifluoromethyl)-, pentyl ester. L-Valine, N-(5-fluoro-2-trifluoromethyl)-, butyl ester. L-Valine, N-(4-fluoro-2-trifluoromethylbenzoyl)-, octyl ester. L-Valine, N-(4-fluoro-2-trifluoromethylbenzoyl)-, octadecyl ester. L-Valine, N-(4-fluoro-2-trifluoromethylbenzoyl)-, pentadecyl ester. L-Valine, N-(4-fluoro-2-trifluoromethylbenzoyl)-, undecyl ester. L-Valine, N-(4-fluoro-2-trifluoromethylbenzoyl)-, dodecyl ester. L-Valine, N-(4-fluoro-2-trifluoromethylbenzoyl)-, heptadecyl ester.

Find more compounds similar to L-Valine, N-(5-fluoro-2-trifluoromethyl)-, octadecyl ester.

Sources

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