Chemical Properties of 2-Hydroxy-2-phenylethylamine di(trifluoroacetyl)- (CAS 13230-75-6)

2-Hydroxy-2-phenylethylamine di(trifluoroacetyl)-

InChI
InChI=1S/C12H9F6NO3/c13-11(14,15)9(20)19-6-8(7-4-2-1-3-5-7)22-10(21)12(16,17)18/h1-5,8H,6H2,(H,19,20)
InChI Key
GLBDCZYKIWFIDR-UHFFFAOYSA-N
Formula
C12H9F6NO3
SMILES
O=C(NCC(OC(=O)C(F)(F)F)c1ccccc1)C(F)(F)F
Molecular Weight1
329.20
CAS
13230-75-6
Other Names
  • 2-Amino-1-phenylethanol, N,O-bis(trifluoroacetyl)-
  • 1-Phenyl-2-[(trifluoroacetyl)amino]ethyl trifluoroacetate
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Physical Properties

Property Value Unit Source
ΔfusH° 32.07 kJ/mol Joback Calculated Property
IE 9.99 eV Relay (1.0) Calculated Property
logPoct/wat 2.512 Crippen Calculated Property
McVol 185.790 ml/mol McGowan Calculated Property
Inp [1330.00; 1330.00]   Show Hide
Inp 1330.00 NIST
Inp 1330.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l 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 [514.29; 570.40] J/mol×K [651.82; 837.52] Show Hide
Cp,gas 514.29 J/mol×K 651.82 Joback Calculated Property
Cp,gas 525.73 J/mol×K 682.77 Joback Calculated Property
Cp,gas 536.27 J/mol×K 713.72 Joback Calculated Property
Cp,gas 545.95 J/mol×K 744.67 Joback Calculated Property
Cp,gas 554.84 J/mol×K 775.62 Joback Calculated Property
Cp,gas 562.97 J/mol×K 806.57 Joback Calculated Property
Cp,gas 570.40 J/mol×K 837.52 Joback Calculated Property

Similar Compounds

m-Octopamine, TFA. 1-[4-(2,2,2-Trifluoroacetoxy)phenyl]-2-[(trifluoroacetyl)amino]ethyl trifluoroacetate. Octopamine, N-acetyl-TFA. 2-Amino-1-phenylethanol, N,O-bis(heptafluorobutyryl)-. (-)-Norepinephrine, N,O,O',O''-tetrakis(trifluoroacetyl)-. Acetamide, N-[2-(acetyloxy)-2-[4-(acetyloxy)phenyl]ethyl]-. p-Octopamine, N-acetate, PFP. OCTOPAMINE TRIPFP. 4-[2-Bis(trifluoroacetyl)amino-1-(trifluoroacetyloxy)ethyl]phenyl trifluoroacetate. p-Synephrine, TFA. m-Synephrine, TFA. (-)-Norepinephrine, N,O,O',O''-tetrakis(pentafluoropropionyl)-. 4-[1-Acetoxy-2-(diacetylamino)ethyl]phenyl acetate. Butanoic acid, heptafluoro-, 4-[2-[(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)amino]-1-(2,2,3,3,4,4,4-heptafluoro-1-oxobutoxy)ethyl]phenyl ester. Acetamide, 1-acetoxy-1-phenyl-2-propyl-.

Find more compounds similar to 2-Hydroxy-2-phenylethylamine di(trifluoroacetyl)-.

Sources

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