Chemical Properties of Glutaric acid, 2,4-dichloronaphthyl ethyl ester

InChI

InChI=1S/C17H16Cl2O4/c1-2-22-15(20)8-5-9-16(21)23-17-12-7-4-3-6-11(12)13(18)10-14(17)19/h3-4,6-7,10H,2,5,8-9H2,1H3

InChI Key

PAMIEEVKNNNNRG-UHFFFAOYSA-N

Formula

C17H16Cl2O4

SMILES

CCOC(=O)CCCC(=O)Oc1c(Cl)cc(Cl)c2ccccc12

Molecular Weight¹

355.22

• 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).
• 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 Pressure, 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	[335.00; 710.70]	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			4.15840e+01
Coefficient B			1.26172e+00
Coefficient C			-7.19400e-04
Coefficient D			1.26800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	335.00	J/mol×K	273.00	Calculated Property
Cp,gas	403.53	J/mol×K	353.78	Calculated Property
Cp,gas	464.43	J/mol×K	434.56	Calculated Property
Cp,gas	518.09	J/mol×K	515.33	Calculated Property
Cp,gas	564.93	J/mol×K	596.11	Calculated Property
Cp,gas	605.34	J/mol×K	676.89	Calculated Property
Cp,gas	639.72	J/mol×K	757.67	Calculated Property
Cp,gas	668.47	J/mol×K	838.44	Calculated Property
Cp,gas	692.00	J/mol×K	919.22	Calculated Property
Cp,gas	710.70	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0006431; 0.0001446]	Pa×s	[522.53; 744.52]	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			-1.23543e+01
Coefficient B			2.61532e+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.			522.53
Temperature range, max.			744.52
η	0.0006431	Pa×s	522.53	Calculated Property
η	0.0005132	Pa×s	547.20	Calculated Property
η	0.0004176	Pa×s	571.86	Calculated Property
η	0.0003457	Pa×s	596.53	Calculated Property
η	0.0002904	Pa×s	621.19	Calculated Property
η	0.0002473	Pa×s	645.86	Calculated Property
η	0.0002131	Pa×s	670.52	Calculated Property
η	0.0001855	Pa×s	695.19	Calculated Property
η	0.0001631	Pa×s	719.85	Calculated Property
η	0.0001446	Pa×s	744.52	Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2,4-dichloronaphthyl ethyl 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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