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

InChI

InChI=1S/C13H14Cl2O4/c1-2-18-12(16)4-3-5-13(17)19-11-7-9(14)6-10(15)8-11/h6-8H,2-5H2,1H3

InChI Key

YXBWOASZRWVBIR-UHFFFAOYSA-N

Formula

C13H14Cl2O4

SMILES

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

Molecular Weight¹

305.16

• 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).
• 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).
• 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, 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	[288.59; 598.16]	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			6.23640e+01
Coefficient B			9.44920e-01
Coefficient C			-4.32120e-04
Coefficient D			2.30000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	288.59	J/mol×K	273.00	Calculated Property
Cp,gas	343.59	J/mol×K	353.78	Calculated Property
Cp,gas	393.27	J/mol×K	434.56	Calculated Property
Cp,gas	437.70	J/mol×K	515.33	Calculated Property
Cp,gas	476.96	J/mol×K	596.11	Calculated Property
Cp,gas	511.11	J/mol×K	676.89	Calculated Property
Cp,gas	540.24	J/mol×K	757.67	Calculated Property
Cp,gas	564.41	J/mol×K	838.44	Calculated Property
Cp,gas	583.69	J/mol×K	919.22	Calculated Property
Cp,gas	598.16	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0009685; 0.0001256]	Pa×s	[432.23; 656.09]	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			-1.29262e+01
Coefficient B			2.58750e+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.			432.23
Temperature range, max.			656.09
η	0.0009685	Pa×s	432.23	Calculated Property
η	0.0006992	Pa×s	457.10	Calculated Property
η	0.0005221	Pa×s	481.98	Calculated Property
η	0.0004012	Pa×s	506.85	Calculated Property
η	0.0003160	Pa×s	531.72	Calculated Property
η	0.0002542	Pa×s	556.60	Calculated Property
η	0.0002084	Pa×s	581.47	Calculated Property
η	0.0001736	Pa×s	606.34	Calculated Property
η	0.0001467	Pa×s	631.22	Calculated Property
η	0.0001256	Pa×s	656.09	Calculated Property

Similar Compounds

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

Sources

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

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