Chemical Properties of (-)-Epinephrine, N,O,O',O''-tetrakis(trifluoroacetyl)-

(-)-Epinephrine, N,O,O',O''-tetrakis(trifluoroacetyl)-

InChI
InChI=1S/C17H9F12NO7/c1-30(10(31)14(18,19)20)5-9(37-13(34)17(27,28)29)6-2-3-7(35-11(32)15(21,22)23)8(4-6)36-12(33)16(24,25)26/h2-4,9H,5H2,1H3
InChI Key
NOEFXLYARFWKQU-UHFFFAOYSA-N
Formula
C17H9F12NO7
SMILES
CN(CC(OC(=O)C(F)(F)F)c1ccc(OC(=O)C(F)(F)F)c(OC(=O)C(F)(F)F)c1)C(=O)C(F)(F)F
Molecular Weight1
567.24
Other Names
  • Epinephrine, TFA
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Physical Properties

Property Value Unit Source
ΔfusH° 54.56 kJ/mol Joback Calculated Property
logPoct/wat 3.789 Crippen Calculated Property
McVol 281.740 ml/mol McGowan Calculated Property
Inp [1520.00; 1538.00]   Show Hide
Inp 1538.00 NIST
Inp 1520.00 NIST
Inp 1520.00 NIST
Inp 1538.00 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [471.63; 914.40] 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 A2.85410e+01
Coefficient B2.00312e+00
Coefficient C-1.49542e-03
Coefficient D3.78160e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 471.63 J/mol×K 273.00 Calculated Property
Cp,gas 566.78 J/mol×K 353.78 Calculated Property
Cp,gas 647.65 J/mol×K 434.56 Calculated Property
Cp,gas 715.43 J/mol×K 515.33 Calculated Property
Cp,gas 771.33 J/mol×K 596.11 Calculated Property
Cp,gas 816.54 J/mol×K 676.89 Calculated Property
Cp,gas 852.26 J/mol×K 757.67 Calculated Property
Cp,gas 879.68 J/mol×K 838.44 Calculated Property
Cp,gas 899.99 J/mol×K 919.22 Calculated Property
Cp,gas 914.40 J/mol×K 1000.00 Calculated Property

Similar Compounds

(.+/-.)-Epinephrine, N,O,O',O''-tetrakis(trifluoroacetyl)-. DL-Metanephrine, N,O,O'-tris(trifluoroacetyl)-. m-Synephrine, TFA. (.+/-.)-Epinephrine, N,O,O',O''-tetrakis(pentafluoropropionyl)-. (-)-Epinephrine, N,O,O',O''-tetrakis(pentafluoropropionyl)-. p-Synephrine, TFA. DL-Metanephrine, N,O,O'-tris(pentafluoropropionyl)-. (-)-Epinephrine, N,O,O',O''-tetrakis(heptafluorobutyryl)-. (.+/-.)-Epinephrine, N,O,O',O''-tetrakis(heptafluorobutyryl)-. DL-Metanephrine, N,O,O'-tris(heptafluorobutyryl)-. (-)-Norepinephrine, N,O,O',O''-tetrakis(trifluoroacetyl)-. (-)-Norepinephrine, N,O,O',O''-tetrakis(pentafluoropropionyl)-. o-Synephrine, TFA. 4-[2-Bis(trifluoroacetyl)amino-1-(trifluoroacetyloxy)ethyl]phenyl trifluoroacetate. Acetamide, N-[2-[3,4-bis(acetyloxy)phenyl]-2-hydroxyethyl]-N-methyl-.

Find more compounds similar to (-)-Epinephrine, N,O,O',O''-tetrakis(trifluoroacetyl)-.

Sources

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