Chemical Properties of Acetamide, N-[2-(acetyloxy)-2-[4-(acetyloxy)phenyl]ethyl]-

Acetamide, N-[2-(acetyloxy)-2-[4-(acetyloxy)phenyl]ethyl]-

InChI
InChI=1S/C14H17NO5/c1-9(16)15-8-14(20-11(3)18)12-4-6-13(7-5-12)19-10(2)17/h4-7,14H,8H2,1-3H3,(H,15,16)
InChI Key
WELBTOLUOPVPJV-UHFFFAOYSA-N
Formula
C14H17NO5
SMILES
CC(=O)NCC(OC(C)=O)c1ccc(OC(C)=O)cc1
Molecular Weight1
279.29
Other Names
  • 4-(2-Aetylamino-1-(acetyloxy)ethyl)phenyl acetate
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Physical Properties

Property Value Unit Source
Δfgas -864.58 kJ/mol Relay (1.0) Calculated Property
Δfus 37.58 kJ/mol Joback Calculated Property
Δvap 97.53 kJ/mol Relay (1.0) Calculated Property
IE 8.48 eV Relay (1.0) Calculated Property
log10WS -1.69 Relay (1.0) Calculated Property
logPoct/wat 1.352 Crippen Calculated Property
McVol 210.790 ml/mol McGowan Calculated Property
Inp 2225.00 NIST
Tboil 592.71 K Relay (1.0) Calculated Property
Tfus 356.60 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor 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 [600.10; 659.70] J/mol×K [771.62; 983.61] Show Hide
Cp,gas 600.10 J/mol×K 771.62 Joback Calculated Property
Cp,gas 612.75 J/mol×K 806.95 Joback Calculated Property
Cp,gas 624.31 J/mol×K 842.28 Joback Calculated Property
Cp,gas 634.76 J/mol×K 877.61 Joback Calculated Property
Cp,gas 644.14 J/mol×K 912.95 Joback Calculated Property
Cp,gas 652.45 J/mol×K 948.28 Joback Calculated Property
Cp,gas 659.70 J/mol×K 983.61 Joback Calculated Property

Similar Compounds

Octopamine, N-acetyl-TFA. 4-[1-Acetoxy-2-(diacetylamino)ethyl]phenyl acetate. 1-[4-(2,2,2-Trifluoroacetoxy)phenyl]-2-[(trifluoroacetyl)amino]ethyl trifluoroacetate. m-Octopamine, TFA. p-Octopamine, N-acetate, PFP. (-)-Norepinephrine, N,O,O',O''-tetrakis(trifluoroacetyl)-. OCTOPAMINE TRIPFP. 4-[2-Bis(trifluoroacetyl)amino-1-(trifluoroacetyloxy)ethyl]phenyl trifluoroacetate. Acetamide, n-(beta,3,4-trihydroxyphenethyl)-, 3,4-diacetate. 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. (-)-Norepinephrine, N,O,O',O''-tetrakis(pentafluoropropionyl)-. p-Synephrine, TFA. 2-Hydroxy-2-phenylethylamine di(trifluoroacetyl)-. (-)-Norepinephrine, N,O,O',O''-tetrakis(heptafluorobutyryl)-. 2-(2,5-Dimethoxy-4-ethylphenyl)-2-acetoxyethylamine, N-acetyl-.

Find more compounds similar to Acetamide, N-[2-(acetyloxy)-2-[4-(acetyloxy)phenyl]ethyl]-.

Sources

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