Chemical Properties of Glutaric acid, 3,5-dichlorophenyl pentyl ester

InChI

InChI=1S/C16H20Cl2O4/c1-2-3-4-8-21-15(19)6-5-7-16(20)22-14-10-12(17)9-13(18)11-14/h9-11H,2-8H2,1H3

InChI Key

JVWATKLLUIQFCD-UHFFFAOYSA-N

Formula

C16H20Cl2O4

SMILES

CCCCCOC(=O)CCCC(=O)Oc1cc(Cl)cc(Cl)c1

Molecular Weight¹

347.23

• 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).
• 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, 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[352.23; 752.94]	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			5.96370e+01
Coefficient B			1.22992e+00
Coefficient C			-5.95320e-04
Coefficient D			5.87000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	352.23	J/mol×K	273.00	Calculated Property
Cp,gas	422.85	J/mol×K	353.78	Calculated Property
Cp,gas	486.50	J/mol×K	434.56	Calculated Property
Cp,gas	543.39	J/mol×K	515.33	Calculated Property
Cp,gas	593.69	J/mol×K	596.11	Calculated Property
Cp,gas	637.60	J/mol×K	676.89	Calculated Property
Cp,gas	675.29	J/mol×K	757.67	Calculated Property
Cp,gas	706.95	J/mol×K	838.44	Calculated Property
Cp,gas	732.77	J/mol×K	919.22	Calculated Property
Cp,gas	752.94	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0007204; 0.0000921]	Pa×s	[466.04; 699.77]	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			-1.33940e+01
Coefficient B			2.86998e+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.			466.04
Temperature range, max.			699.77
η	0.0007204	Pa×s	466.04	Calculated Property
η	0.0005205	Pa×s	492.01	Calculated Property
η	0.0003885	Pa×s	517.98	Calculated Property
η	0.0002982	Pa×s	543.95	Calculated Property
η	0.0002345	Pa×s	569.92	Calculated Property
η	0.0001883	Pa×s	595.89	Calculated Property
η	0.0001540	Pa×s	621.86	Calculated Property
η	0.0001280	Pa×s	647.83	Calculated Property
η	0.0001079	Pa×s	673.80	Calculated Property
η	0.0000921	Pa×s	699.77	Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 3,5-dichlorophenyl pentyl ester.

Sources

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

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