Chemical Properties of 1,2-Propanediol, dibenzoate

InChI

InChI=1S/C17H16O4/c1-13(21-17(19)15-10-6-3-7-11-15)12-20-16(18)14-8-4-2-5-9-14/h2-11,13H,12H2,1H3

InChI Key

UMVMVEZHMZTUHD-UHFFFAOYSA-N

Formula

C17H16O4

SMILES

CC(COC(=O)c1ccccc1)OC(=O)c1ccccc1

Molecular Weight¹

284.31

Other Names

• propane-1,2-diyl dibenzoate

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization 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).
• P_c : Critical Pressure (kPa).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Standard Gibbs free energy of formation for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[614.70; 680.74]	J/mol×K	[793.86; 1029.01]
Cp,gas	614.70	J/mol×K	793.86	Joback Calculated Property
Cp,gas	628.81	J/mol×K	833.05	Joback Calculated Property
Cp,gas	641.63	J/mol×K	872.24	Joback Calculated Property
Cp,gas	653.19	J/mol×K	911.43	Joback Calculated Property
Cp,gas	663.54	J/mol×K	950.63	Joback Calculated Property
Cp,gas	672.71	J/mol×K	989.82	Joback Calculated Property
Cp,gas	680.74	J/mol×K	1029.01	Joback Calculated Property
η	[0.0000761; 0.0009003]	Pa×s	[463.51; 793.86]
η	0.0009003	Pa×s	463.51	Joback Calculated Property
η	0.0004793	Pa×s	518.57	Joback Calculated Property
η	0.0002880	Pa×s	573.63	Joback Calculated Property
η	0.0001892	Pa×s	628.69	Joback Calculated Property
η	0.0001330	Pa×s	683.74	Joback Calculated Property
η	0.0000985	Pa×s	738.80	Joback Calculated Property
η	0.0000761	Pa×s	793.86	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,2-Propanediol, dibenzoate.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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