Chemical Properties of Aspartic acid-phenylalanine, N(«alpha»,«epsilon»)-trifluoroacetyl-N-O-permethyl derivative

Aspartic acid-phenylalanine, N(«alpha»,«epsilon»)-trifluoroacetyl-N-O-permethyl derivative

InChI
InChI=1S/C19H23F3N2O6/c1-23(14(17(27)30-4)10-12-8-6-5-7-9-12)16(26)13(11-15(25)29-3)24(2)18(28)19(20,21)22/h5-9,13-14H,10-11H2,1-4H3
InChI Key
LCJUOZRBMKERRC-UHFFFAOYSA-N
Formula
C19H23F3N2O6
SMILES
COC(=O)CC(C(=O)N(C)C(Cc1ccccc1)C(=O)OC)N(C)C(=O)C(F)(F)F
Molecular Weight1
432.39
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Physical Properties

Property Value Unit Source
ΔfusH° 51.77 kJ/mol Joback Calculated Property
IE 8.77 eV Relay (1.0) Calculated Property
logPoct/wat 1.181 Crippen Calculated Property
McVol 298.100 ml/mol McGowan Calculated Property
Inp [2235.00; 2294.00]   Show Hide
Inp 2235.00 NIST
Inp 2294.00 NIST
Inp 2235.00 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [439.33; 975.10] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-1.36980e+01
Coefficient B1.98518e+00
Coefficient C-1.26700e-03
Coefficient D2.70620e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 439.33 J/mol×K 273.00 Calculated Property
Cp,gas 542.02 J/mol×K 353.78 Calculated Property
Cp,gas 631.92 J/mol×K 434.56 Calculated Property
Cp,gas 709.89 J/mol×K 515.33 Calculated Property
Cp,gas 776.79 J/mol×K 596.11 Calculated Property
Cp,gas 833.47 J/mol×K 676.89 Calculated Property
Cp,gas 880.78 J/mol×K 757.67 Calculated Property
Cp,gas 919.59 J/mol×K 838.44 Calculated Property
Cp,gas 950.74 J/mol×K 919.22 Calculated Property
Cp,gas 975.10 J/mol×K 1000.00 Calculated Property

Similar Compounds

Serine-lysine-tyrosine, N(«alpha»,«epsilon»)-trifluoroacetyl-N-O-permethyl derivative. Lysine-tyrosine, N(«alpha»,«epsilon»)-trifluoroacetyl-N-O-permethyl derivative. xanthosine-5'-monophosphate, TMS. 9H-purine-6(1h)-thione, 9-beta-d-ribofuranosyl-, 2',3'-diacetate, 5'-bis(3,5-dimethylphenyl)phosphate. norbormide. Cialis. (2-Hydroxy-3-phenyl-1,2-dihydroquinoxalin-1-yl)phenyl(3-phenyl-1-benzyl-1,2-dihydroquinoxalin-2-yl)methane. inosine-5'-monophosphate, TMS. Quinine, trimethylsilyl ether. N6-TFA-2'-Deoxyadenosine, 3'-O-TBDMS, 5'-O-TFA. N6-TFA-2'-Deoxyadenosine, 3'-O-TFA, 5'-O-TBDMS. xanthosine, TMS. Dehydrojaconine. Dihydromorphine , di(trimehylsilyl) ether. Deserpidine.

Find more compounds similar to Aspartic acid-phenylalanine, N(«alpha»,«epsilon»)-trifluoroacetyl-N-O-permethyl derivative.

Sources

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