Chemical Properties of l-Phenylalanine, n-heptafluorobutyryl-, butyl ester

l-Phenylalanine, n-heptafluorobutyryl-, butyl ester

InChI
InChI=1S/C17H18F7NO3/c1-2-3-9-28-13(26)12(10-11-7-5-4-6-8-11)25-14(27)15(18,19)16(20,21)17(22,23)24/h4-8,12H,2-3,9-10H2,1H3,(H,25,27)
InChI Key
OCQYHUKFEDQUNZ-UHFFFAOYSA-N
Formula
C17H18F7NO3
SMILES
CCCCOC(=O)C(Cc1ccccc1)NC(=O)C(F)(F)C(F)(F)C(F)(F)F
Molecular Weight1
417.32
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Physical Properties

Property Value Unit Source
ω 0.7501 Relay (1.0) Calculated Property
ΔfusH° 40.69 kJ/mol Joback Calculated Property
log10WS -5.30 Relay (1.0) Calculated Property
logPoct/wat 3.890 Crippen Calculated Property
McVol 258.010 ml/mol McGowan Calculated Property
Pc 1384.02 kPa Joback Calculated Property
Inp 1732.00 NIST
Tboil 576.45 K Relay (1.0) Calculated Property
Tc 736.61 K Relay (1.0) Calculated Property
Tfus 303.56 K Relay (1.0) Calculated Property
Vc 0.924 m3/kmol Relay (1.0) Calculated Property

Cheméo can also estimate Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [788.43; 852.53] J/mol×K [762.26; 946.66] Show Hide
Cp,gas 788.43 J/mol×K 762.26 Joback Calculated Property
Cp,gas 801.29 J/mol×K 792.99 Joback Calculated Property
Cp,gas 813.19 J/mol×K 823.73 Joback Calculated Property
Cp,gas 824.19 J/mol×K 854.46 Joback Calculated Property
Cp,gas 834.36 J/mol×K 885.20 Joback Calculated Property
Cp,gas 843.79 J/mol×K 915.93 Joback Calculated Property
Cp,gas 852.53 J/mol×K 946.66 Joback Calculated Property

Similar Compounds

l-Phenylalanine, n-heptafluorobutyryl-, pentyl ester. l-Phenylalanine, n-heptafluorobutyryl-, hexyl ester. l-Phenylalanine, n-heptafluorobutyryl-, undecyl ester. L-Phenylalanine, N-heptafluorobutyryl-, pentadecyl ester. l-Phenylalanine, n-heptafluorobutyryl-, heptadecyl ester. l-Phenylalanine, n-heptafluorobutyryl-, octadecyl ester. l-Phenylalanine, n-heptafluorobutyryl-, decyl ester. l-Phenylalanine, n-heptafluorobutyryl-, dodecyl ester. l-Phenylalanine, n-heptafluorobutyryl-, tetradecyl ester. L-Phenylalanine, N-heptafluorobutyryl-, nonyl ester. L-Phenylalanine, N-heptafluorobutyryl-, hexadecyl ester. l-Phenylalanine, n-heptafluorobutyryl-, propyl ester. L-phenylalanine, n-heptafluorobutyryl-, ethyl ester. L-Phenylalanine, N-pentafluoropropionyl-, butyl ester. l-Phenylalanine, n-heptafluorobutyryl-, isohexyl ester.

Find more compounds similar to l-Phenylalanine, n-heptafluorobutyryl-, butyl ester.

Sources

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