Chemical Properties of Toliprolol desamino hydroxy, acetylated

InChI

InChI=1S/C14H18O5/c1-10-5-4-6-13(7-10)18-9-14(19-12(3)16)8-17-11(2)15/h4-7,14H,8-9H2,1-3H3

InChI Key

YBZAUDYBEYBZHG-UHFFFAOYSA-N

Formula

C14H18O5

SMILES

CC(=O)OCC(COc1cccc(C)c1)OC(C)=O

Molecular Weight¹

266.29

• 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).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate 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 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	[567.18; 638.67]	J/mol×K	[725.94; 933.66]
Cp,gas	567.18	J/mol×K	725.94	Joback Calculated Property
Cp,gas	581.49	J/mol×K	760.56	Joback Calculated Property
Cp,gas	594.85	J/mol×K	795.18	Joback Calculated Property
Cp,gas	607.26	J/mol×K	829.80	Joback Calculated Property
Cp,gas	618.70	J/mol×K	864.42	Joback Calculated Property
Cp,gas	629.17	J/mol×K	899.04	Joback Calculated Property
Cp,gas	638.67	J/mol×K	933.66	Joback Calculated Property
η	[0.0000849; 0.0008224]	Pa×s	[438.03; 725.94]
η	0.0008224	Pa×s	438.03	Joback Calculated Property
η	0.0004673	Pa×s	486.01	Joback Calculated Property
η	0.0002940	Pa×s	534.00	Joback Calculated Property
η	0.0001996	Pa×s	581.99	Joback Calculated Property
η	0.0001438	Pa×s	629.97	Joback Calculated Property
η	0.0001085	Pa×s	677.96	Joback Calculated Property
η	0.0000849	Pa×s	725.94	Joback Calculated Property

Similar Compounds

Find more compounds similar to Toliprolol desamino hydroxy, 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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