Chemical Properties of Dopamine, N-acetyl-TFA

Dopamine, N-acetyl-TFA

InChI
InChI=1S/C14H11F6NO5/c1-7(22)21-5-4-8-2-3-9(25-11(23)13(15,16)17)10(6-8)26-12(24)14(18,19)20/h2-3,6H,4-5H2,1H3,(H,21,22)
InChI Key
SFNUCMZHIIYINK-UHFFFAOYSA-N
Formula
C14H11F6NO5
SMILES
CC(=O)NCCc1ccc(OC(=O)C(F)(F)F)c(OC(=O)C(F)(F)F)c1
Molecular Weight1
387.23
Other Names
  • Dopamine, N-acetate, TFA
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Physical Properties

Property Value Unit Source
ΔfusH° 44.37 kJ/mol Joback Calculated Property
logPoct/wat 2.301 Crippen Calculated Property
McVol 221.410 ml/mol McGowan Calculated Property
Inp [1588.00; 1588.00]   Show Hide
Inp 1588.00 NIST
Inp 1588.00 NIST
Inp 1588.00 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, Ionization energy, 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 [649.10; 697.04] J/mol×K [766.20; 954.71] Show Hide
Cp,gas 649.10 J/mol×K 766.20 Joback Calculated Property
Cp,gas 659.18 J/mol×K 797.62 Joback Calculated Property
Cp,gas 668.38 J/mol×K 829.04 Joback Calculated Property
Cp,gas 676.73 J/mol×K 860.45 Joback Calculated Property
Cp,gas 684.27 J/mol×K 891.87 Joback Calculated Property
Cp,gas 691.02 J/mol×K 923.29 Joback Calculated Property
Cp,gas 697.04 J/mol×K 954.71 Joback Calculated Property

Similar Compounds

Dopamine, N-acetyl-PFP. 3-Hydroxytyramine, N,O,O'-tris(trifluoroacetyl)-. Acetamide, N-[2-(3,4-dimethoxyphenyl)ethyl]-. Propanoic acid, pentafluoro-, 4-[2-[(2,2,3,3,3-pentafluoro-1-oxopropyl)amino]ethyl]-1,2-phenylene ester. N-acetyltyramine-TFA. BENZENETHANAMINE, N-TFA-3,4-DIMETHOXY-. Butanoic acid, heptafluoro-, 4-[2-[(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)amino]ethyl]-1,2-phenylene ester. Tyramine, N-acetate, PFP. Acetamide, n-(beta,3,4-trihydroxyphenethyl)-, 3,4-diacetate. 3,4-Dimethoxyphenylethylamine, N-pentafluoropropionyl-. 2,5-Dimethoxy-4-methyl-«beta»-phenethylamine-M (O-desmethyl-N-acetyl-), TFA, II. 2,5-Dimethoxy-4-methyl-«beta»-phenethylamine-M (O-desmethyl-N-acetyl-), TFA, I. 4-ethyl-2,5-dimethoxy-«beta»-phenethylamine-M, (HO-N-acetyl-), 2TFA. Fumaric acid, monoamide, N-(3,4-dimethoxyphenethyl)-, 3,5-difluorophenyl ester. (-)-Norepinephrine, N,O,O',O''-tetrakis(trifluoroacetyl)-.

Find more compounds similar to Dopamine, N-acetyl-TFA.

Sources

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