Chemical Properties of Glutaric acid, 2,3-dichlorophenyl 4-biphenyl ester

InChI

InChI=1S/C23H18Cl2O4/c24-19-8-4-9-20(23(19)25)29-22(27)11-5-10-21(26)28-18-14-12-17(13-15-18)16-6-2-1-3-7-16/h1-4,6-9,12-15H,5,10-11H2

InChI Key

TZVPTAKELRUGEK-UHFFFAOYSA-N

Formula

C23H18Cl2O4

SMILES

O=C(CCCC(=O)Oc1cccc(Cl)c1Cl)Oc1ccc(-c2ccccc2)cc1

Molecular Weight¹

429.29

• 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).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	53.41	kJ/mol	Joback Calculated Property
logPoct/wat	6.342		Crippen Calculated Property
McVol	303.010	ml/mol	McGowan Calculated Property
Inp	[3533.00; 3533.00]
Inp	3533.00		NIST
Inp	3533.00		NIST
Tboil	739.64	K	Relay (1.0) Calculated Property

Cheméo can also estimate 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[388.76; 873.98]	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			-2.37000e-01
Coefficient B			1.67760e+00
Coefficient C			-9.71480e-04
Coefficient D			1.68100e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	388.76	J/mol×K	273.00	Calculated Property
Cp,gas	479.11	J/mol×K	353.78	Calculated Property
Cp,gas	559.11	J/mol×K	434.56	Calculated Property
Cp,gas	629.30	J/mol×K	515.33	Calculated Property
Cp,gas	690.19	J/mol×K	596.11	Calculated Property
Cp,gas	742.33	J/mol×K	676.89	Calculated Property
Cp,gas	786.25	J/mol×K	757.67	Calculated Property
Cp,gas	822.48	J/mol×K	838.44	Calculated Property
Cp,gas	851.54	J/mol×K	919.22	Calculated Property
Cp,gas	873.98	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0002159; 0.0000357]	Pa×s	[610.29; 884.13]	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			-1.42488e+01
Coefficient B			3.54468e+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.			610.29
Temperature range, max.			884.13
η	0.0002159	Pa×s	610.29	Calculated Property
η	0.0001639	Pa×s	640.72	Calculated Property
η	0.0001275	Pa×s	671.14	Calculated Property
η	0.0001014	Pa×s	701.57	Calculated Property
η	0.0000822	Pa×s	732.00	Calculated Property
η	0.0000678	Pa×s	762.43	Calculated Property
η	0.0000567	Pa×s	792.85	Calculated Property
η	0.0000480	Pa×s	823.28	Calculated Property
η	0.0000412	Pa×s	853.71	Calculated Property
η	0.0000357	Pa×s	884.13	Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2,3-dichlorophenyl 4-biphenyl ester.

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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