Chemical Properties of L-Ornithine, N2,N5-bis(trifluoroacetyl)-, butyl ester (CAS 2804-68-4)

L-Ornithine, N2,N5-bis(trifluoroacetyl)-, butyl ester

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InChI
InChI=1S/C13H18F6N2O4/c1-2-3-7-25-9(22)8(21-11(24)13(17,18)19)5-4-6-20-10(23)12(14,15)16/h8H,2-7H2,1H3,(H,20,23)(H,21,24)/t8-/m1/s1
InChI Key
LMGYQYJQQMTKTR-MRVPVSSYSA-N
Formula
C13H18F6N2O4
SMILES
CCCCOC(=O)C(CCCNC(=O)C(F)(F)F)NC(=O)C(F)(F)F
Molecular Weight1
380.28
CAS
2804-68-4
Other Names
  • Ornitine, butyl ester, N2,N5-bis-TFA
  • Ornitine, butyl ester, TFA
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Physical Properties

Property Value Unit Source
Δf -1420.02 kJ/mol Joback Calculated Property
Δfgas -1874.11 kJ/mol Joback Calculated Property
Δfus 45.74 kJ/mol Joback Calculated Property
Δvap 72.17 kJ/mol Joback Calculated Property
log10WS -3.49 Crippen Calculated Property
logPoct/wat 1.836 Crippen Calculated Property
McVol 235.190 ml/mol McGowan Calculated Property
Pc 1610.29 kPa Joback Calculated Property
Inp [1690.00; 1690.00]   Show Hide
Inp 1690.00 NIST
Inp 1690.00 NIST
Tboil 769.93 K Joback Calculated Property
Tc 948.10 K Joback Calculated Property
Tfus 506.99 K Joback Calculated Property
Vc 0.950 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [723.56; 782.34] J/mol×K [769.93; 948.10] Show Hide
Cp,gas 723.56 J/mol×K 769.93 Joback Calculated Property
Cp,gas 735.15 J/mol×K 799.63 Joback Calculated Property
Cp,gas 745.96 J/mol×K 829.32 Joback Calculated Property
Cp,gas 756.05 J/mol×K 859.02 Joback Calculated Property
Cp,gas 765.45 J/mol×K 888.71 Joback Calculated Property
Cp,gas 774.20 J/mol×K 918.41 Joback Calculated Property
Cp,gas 782.34 J/mol×K 948.10 Joback Calculated Property

Similar Compounds

Lysine, N,N-di(trifluoroacetyl)-, n-butyl ester. L-Norleucine, N-(trifluoroacetyl)-, butyl ester. 2-Aminoadipic acid, N-trifluoroacetyl-, di-n-butyl ester. ornithine, trifluoroacetyl-isopropyl ester. L-Leucine, N-(trifluoroacetyl)-, butyl ester. l-Leucine, n-pentafluoropropionyl-, hexadecyl ester. l-Leucine, n-pentafluoropropionyl-, undecyl ester. l-Leucine, n-pentafluoropropionyl-, pentadecyl ester. l-Leucine-, n-pentafluoropropionyl-, decyl ester. l-Leucine, n-pentafluoropropionyl-, heptadecyl ester. l-Leucine, n-pentafluoropropionyl-, nonyl ester. l-Leucine, n-pentafluoropropionyl-, hexyl ester. l-Leucine, n-pentafluoropropionyl-, pentyl ester. l-Leucine, n-pentafluoropropionyl-, butyl ester. N-«alpha»-Acetyl lysine, butyl ester.

Find more compounds similar to L-Ornithine, N2,N5-bis(trifluoroacetyl)-, butyl ester.

Sources

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