Chemical Properties of DIBENZYL ADIPATE

InChI

InChI=1S/C20H22O4/c21-19(23-15-17-9-3-1-4-10-17)13-7-8-14-20(22)24-16-18-11-5-2-6-12-18/h1-6,9-12H,7-8,13-16H2

InChI Key

AEUORZZHALJMBM-UHFFFAOYSA-N

Formula

C20H22O4

SMILES

O=C(CCCCC(=O)OCc1ccccc1)OCc1ccccc1

Molecular Weight¹

326.39

• 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).
• 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).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical 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 Volume, Enthalpy of formation 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[347.92; 830.32]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-3.22840e+01
Coefficient B			1.63640e+00
Coefficient C			-9.37400e-04
Coefficient D			1.63600e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	347.92	J/mol×K	273.00	Calculated Property
Cp,gas	436.56	J/mol×K	353.78	Calculated Property
Cp,gas	515.23	J/mol×K	434.56	Calculated Property
Cp,gas	584.45	J/mol×K	515.33	Calculated Property
Cp,gas	644.74	J/mol×K	596.11	Calculated Property
Cp,gas	696.62	J/mol×K	676.89	Calculated Property
Cp,gas	740.60	J/mol×K	757.67	Calculated Property
Cp,gas	777.19	J/mol×K	838.44	Calculated Property
Cp,gas	806.93	J/mol×K	919.22	Calculated Property
Cp,gas	830.32	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0008936; 0.0000688]	Pa×s	[452.66; 732.35]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.37359e+01
Coefficient B			3.03992e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			452.66
Temperature range, max.			732.35
η	0.0008936	Pa×s	452.66	Calculated Property
η	0.0005805	Pa×s	483.74	Calculated Property
η	0.0003972	Pa×s	514.81	Calculated Property
η	0.0002838	Pa×s	545.89	Calculated Property
η	0.0002103	Pa×s	576.97	Calculated Property
η	0.0001606	Pa×s	608.05	Calculated Property
η	0.0001260	Pa×s	639.12	Calculated Property
η	0.0001010	Pa×s	670.20	Calculated Property
η	0.0000826	Pa×s	701.28	Calculated Property
η	0.0000688	Pa×s	732.35	Calculated Property

Similar Compounds

Find more compounds similar to DIBENZYL ADIPATE.

Sources

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

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