Chemical Properties of 4-[1-Acetoxy-2-(diacetylamino)ethyl]phenyl acetate

4-[1-Acetoxy-2-(diacetylamino)ethyl]phenyl acetate

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InChI
InChI=1S/C16H19NO6/c1-10(18)17(11(2)19)9-16(23-13(4)21)14-5-7-15(8-6-14)22-12(3)20/h5-8,16H,9H2,1-4H3
InChI Key
WXBPPNDYHGULCD-UHFFFAOYSA-N
Formula
C16H19NO6
SMILES
CC(=O)Oc1ccc(C(CN(C(C)=O)C(C)=O)OC(C)=O)cc1
Molecular Weight1
321.33
Other Names
  • 1-(4-Acetyloxyphenyl)-2-diacetylaminoethanol acetate
  • 4-[2-Diacetylamino-1-acetyloxyethyl]phenol acetate
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Physical Properties

Property Value Unit Source
ΔfG° -430.72 kJ/mol Joback Calculated Property
ΔfH°gas -801.02 kJ/mol Joback Calculated Property
ΔfusH° 39.12 kJ/mol Joback Calculated Property
ΔvapH° 87.61 kJ/mol Joback Calculated Property
log10WS -2.54 Crippen Calculated Property
logPoct/wat 1.611 Crippen Calculated Property
McVol 240.540 ml/mol McGowan Calculated Property
Pc 2040.07 kPa Joback Calculated Property
Inp 2304.00 NIST
Tboil 869.46 K Joback Calculated Property
Tc 1085.87 K Joback Calculated Property
Tfus 570.67 K Joback Calculated Property
Vc 0.895 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [717.55; 771.60] J/mol×K [869.46; 1085.87] Show Hide
Cp,gas 717.55 J/mol×K 869.46 Joback Calculated Property
Cp,gas 729.33 J/mol×K 905.53 Joback Calculated Property
Cp,gas 739.98 J/mol×K 941.60 Joback Calculated Property
Cp,gas 749.51 J/mol×K 977.67 Joback Calculated Property
Cp,gas 757.94 J/mol×K 1013.73 Joback Calculated Property
Cp,gas 765.30 J/mol×K 1049.80 Joback Calculated Property
Cp,gas 771.60 J/mol×K 1085.87 Joback Calculated Property

Similar Compounds

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

Find more compounds similar to 4-[1-Acetoxy-2-(diacetylamino)ethyl]phenyl acetate.

Sources

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