Chemical Properties of Acetamide, N-[2-[3,4-bis(acetyloxy)phenyl]-2-hydroxyethyl]-N-methyl- (CAS 55712-68-0)

Acetamide, N-[2-[3,4-bis(acetyloxy)phenyl]-2-hydroxyethyl]-N-methyl-

InChI
InChI=1S/C15H19NO6/c1-9(17)16(4)8-13(20)12-5-6-14(21-10(2)18)15(7-12)22-11(3)19/h5-7,13,20H,8H2,1-4H3
InChI Key
VIEBAWINIWTURC-UHFFFAOYSA-N
Formula
C15H19NO6
SMILES
CC(=O)Oc1ccc(C(O)CN(C)C(C)=O)cc1OC(C)=O
Molecular Weight1
309.31
CAS
55712-68-0
Other Names
  • Acetamide, N-methyl-N-(beta,3,4-trihydroxyphenethyl)-, 3,4-diacetate
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
ΔfusH° 41.79 kJ/mol Joback Calculated Property
logPoct/wat 1.049 Crippen Calculated Property
McVol 230.750 ml/mol McGowan Calculated Property

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 [692.31; 741.30] J/mol×K [853.93; 1057.91] Show Hide
Cp,gas 692.31 J/mol×K 853.93 Joback Calculated Property
Cp,gas 703.03 J/mol×K 887.93 Joback Calculated Property
Cp,gas 712.70 J/mol×K 921.92 Joback Calculated Property
Cp,gas 721.35 J/mol×K 955.92 Joback Calculated Property
Cp,gas 728.99 J/mol×K 989.92 Joback Calculated Property
Cp,gas 735.63 J/mol×K 1023.92 Joback Calculated Property
Cp,gas 741.30 J/mol×K 1057.91 Joback Calculated Property

Similar Compounds

Acetamide, n-(beta,3,4-trihydroxyphenethyl)-, 3,4-diacetate. DL-Metanephrine, N,O,O'-tris(trifluoroacetyl)-. (-)-Epinephrine, N,O,O',O''-tetrakis(trifluoroacetyl)-. (.+/-.)-Epinephrine, N,O,O',O''-tetrakis(trifluoroacetyl)-. DL-Metanephrine, N,O,O'-tris(pentafluoropropionyl)-. (-)-Epinephrine, N,O,O',O''-tetrakis(pentafluoropropionyl)-. (.+/-.)-Epinephrine, N,O,O',O''-tetrakis(pentafluoropropionyl)-. DL-Metanephrine, N,O,O'-tris(heptafluorobutyryl)-. (-)-Epinephrine, N,O,O',O''-tetrakis(heptafluorobutyryl)-. (.+/-.)-Epinephrine, N,O,O',O''-tetrakis(heptafluorobutyryl)-. 2-[[tert-Butyl(dimethyl)silyl](methyl)amino]-1-(4-pyrrol[tert-butyl(dimethyl)silyl]oxymorpho-3-methoxyphenyl)ethanol. 4-[2-(4-Allyl-2,6-dimethoxy-phenoxy)-1-hydroxy-propyl]-2-methoxy-phenol, TPS. Ethylephrine, N-TFA-O-TMS. dl-Metanephrine, N,O,O'-(tert-butyldimethylsilyl)-. Desipramine M(HO), acetylated.

Find more compounds similar to Acetamide, N-[2-[3,4-bis(acetyloxy)phenyl]-2-hydroxyethyl]-N-methyl-.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
These property values are available through the Cheméo API. A free account gives you an access key.