Chemical Properties of Alprenolol desaminohydroxy, acetylated

InChI

InChI=1S/C16H20O5/c1-4-7-14-8-5-6-9-16(14)20-11-15(21-13(3)18)10-19-12(2)17/h4-6,8-9,15H,1,7,10-11H2,2-3H3

InChI Key

HPBBAFJJVJUGNE-UHFFFAOYSA-N

Formula

C16H20O5

SMILES

C=CCc1ccccc1OCC(COC(C)=O)OC(C)=O

Molecular Weight¹

292.33

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, 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 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	[641.22; 714.46]	J/mol×K	[732.44; 934.87]
Cp,gas	641.22	J/mol×K	732.44	Joback Calculated Property
Cp,gas	656.10	J/mol×K	766.18	Joback Calculated Property
Cp,gas	669.90	J/mol×K	799.92	Joback Calculated Property
Cp,gas	682.63	J/mol×K	833.66	Joback Calculated Property
Cp,gas	694.30	J/mol×K	867.40	Joback Calculated Property
Cp,gas	704.91	J/mol×K	901.14	Joback Calculated Property
Cp,gas	714.46	J/mol×K	934.87	Joback Calculated Property
η	[0.0000552; 0.0011621]	Pa×s	[399.15; 732.44]
η	0.0011621	Pa×s	399.15	Joback Calculated Property
η	0.0005128	Pa×s	454.70	Joback Calculated Property
η	0.0002704	Pa×s	510.25	Joback Calculated Property
η	0.0001616	Pa×s	565.80	Joback Calculated Property
η	0.0001059	Pa×s	621.34	Joback Calculated Property
η	0.0000744	Pa×s	676.89	Joback Calculated Property
η	0.0000552	Pa×s	732.44	Joback Calculated Property

Similar Compounds

Find more compounds similar to Alprenolol desaminohydroxy, acetylated.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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