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
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Physical Properties

Property Value Unit Source
ω 0.8983 Relay (1.0) Calculated Property
ΔfG° -2863.29 kJ/mol Joback Calculated Property
ΔfH°gas -3478.86 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 49.81 kJ/mol Joback Calculated Property
ΔvapH° 94.19 kJ/mol Relay (1.0) Calculated Property
IE 9.84 eV Relay (1.0) Calculated Property
log10WS -5.42 Relay (1.0) Calculated Property
logPoct/wat 3.789 Crippen Calculated Property
McVol 281.740 ml/mol McGowan Calculated Property
Pc 1270.06 kPa Joback Calculated Property
Inp [1538.00; 1538.00]   Show Hide
Inp 1538.00 NIST
Inp 1538.00 NIST
Tboil 534.83 K Relay (1.0) Calculated Property
Tc 749.46 K Relay (1.0) Calculated Property
Tfus 357.55 K Relay (1.0) Calculated Property
Vc 1.064 m3/kmol Relay (1.0) Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [889.85; 928.54] J/mol×K [898.06; 1099.73] Show Hide
Cp,gas 889.85 J/mol×K 898.06 Joback Calculated Property
Cp,gas 898.23 J/mol×K 931.67 Joback Calculated Property
Cp,gas 905.73 J/mol×K 965.28 Joback Calculated Property
Cp,gas 912.42 J/mol×K 998.90 Joback Calculated Property
Cp,gas 918.40 J/mol×K 1032.51 Joback Calculated Property
Cp,gas 923.75 J/mol×K 1066.12 Joback Calculated Property
Cp,gas 928.54 J/mol×K 1099.73 Joback 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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