Chemical Properties of L-phenylalanine, n-pentafluoropropionyl-, heptadecyl ester

L-phenylalanine, n-pentafluoropropionyl-, heptadecyl ester

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InChI
InChI=1S/C29H44F5NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-38-26(36)25(23-24-20-17-16-18-21-24)35-27(37)28(30,31)29(32,33)34/h16-18,20-21,25H,2-15,19,22-23H2,1H3,(H,35,37)
InChI Key
DYEVCFBWRFGXBK-UHFFFAOYSA-N
Formula
C29H44F5NO3
SMILES
CCCCCCCCCCCCCCCCCOC(=O)C(Cc1ccccc1)NC(=O)C(F)(F)C(F)(F)F
Molecular Weight1
549.66
Sources

Physical Properties

Property Value Unit Source
Δf -938.55 kJ/mol Joback Calculated Property
Δfgas -1712.60 kJ/mol Joback Calculated Property
Δfus 71.44 kJ/mol Joback Calculated Property
Δvap 97.70 kJ/mol Joback Calculated Property
logPoct/wat 8.33 Crippen Calculated Property
Pc 719.53 kPa Joback Calculated Property
Tboil 1059.38 K Joback Calculated Property
Tc 1318.63 K Joback Calculated Property
Tfus 610.55 K Joback Calculated Property
Vc 1.68 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1498.99 J/mol×K 1059.38 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 1
-F 5
>C=O (nonring) 2
=CH- (ring) 5
=C< (ring) 1
-CH2- 17
>C< 2
>NH 1
-CH3 1

Similar Compounds

L-phenylalanine, n-pentafluoropropionyl-, hexadecyl ester. L-phenylalanine, n-pentafluoropropionyl-, decyl ester. L-phenylalanine, n-pentafluoropropionyl-, pentadecyl ester. L-phenylalanine, n-pentafluoropropionyl-, undecyl ester. L-phenylalanine, n-pentafluoropropionyl-, dodecyl ester. L-phenylalanine, n-pentafluoropropionyl-, octyl ester. L-phenylalanine, n-pentafluoropropionyl-, tetradecyl ester. L-phenylalanine, n-pentafluoropropionyl-, octadecyl ester. L-phenylalanine, n-pentafluoropropionyl-, isohexyl ester. L-phenylalanine, n-pentafluoropropionyl-, ethyl ester. L-phenylalanine, n-pentafluoropropionyl-, isobutyl ester. Phe,TFE-PFP. Phe, HFIP-PFP. L-phenylalanine, n-heptafluorobutyryl-, tetradecyl ester. L-phenylalanine, n-heptafluorobutyryl-, octadecyl ester.

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