Chemical Properties of Glutaric acid, butyl 2-(2-chlorophenoxy)ethyl ester

InChI

InChI=1S/C17H23ClO5/c1-2-3-11-22-16(19)9-6-10-17(20)23-13-12-21-15-8-5-4-7-14(15)18/h4-5,7-8H,2-3,6,9-13H2,1H3

InChI Key

YADQGZCXUROKDI-UHFFFAOYSA-N

Formula

C17H23ClO5

SMILES

CCCCOC(=O)CCCC(=O)OCCOc1ccccc1Cl

Molecular Weight¹

342.81

• 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	[372.89; 817.80]	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			5.70380e+01
Coefficient B			1.31442e+00
Coefficient C			-5.85360e-04
Coefficient D			3.17000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	372.89	J/mol×K	273.00	Calculated Property
Cp,gas	450.19	J/mol×K	353.78	Calculated Property
Cp,gas	520.29	J/mol×K	434.56	Calculated Property
Cp,gas	583.29	J/mol×K	515.33	Calculated Property
Cp,gas	639.29	J/mol×K	596.11	Calculated Property
Cp,gas	688.39	J/mol×K	676.89	Calculated Property
Cp,gas	730.69	J/mol×K	757.67	Calculated Property
Cp,gas	766.29	J/mol×K	838.44	Calculated Property
Cp,gas	795.29	J/mol×K	919.22	Calculated Property
Cp,gas	817.80	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0006737; 0.0000719]	Pa×s	[457.10; 697.55]	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			-1.37918e+01
Coefficient B			2.96617e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			457.10
Temperature range, max.			697.55
η	0.0006737	Pa×s	457.10	Calculated Property
η	0.0004708	Pa×s	483.82	Calculated Property
η	0.0003416	Pa×s	510.53	Calculated Property
η	0.0002559	Pa×s	537.25	Calculated Property
η	0.0001970	Pa×s	563.97	Calculated Property
η	0.0001553	Pa×s	590.69	Calculated Property
η	0.0001250	Pa×s	617.40	Calculated Property
η	0.0001024	Pa×s	644.12	Calculated Property
η	0.0000852	Pa×s	670.84	Calculated Property
η	0.0000719	Pa×s	697.55	Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, butyl 2-(2-chlorophenoxy)ethyl ester.

Sources

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

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