Chemical Properties of Glutaric acid, 2-chloropropyl hexyl ester

InChI

InChI=1S/C14H25ClO4/c1-3-4-5-6-10-18-13(16)8-7-9-14(17)19-11-12(2)15/h12H,3-11H2,1-2H3

InChI Key

XLZQYGBZPBDKRY-UHFFFAOYSA-N

Formula

C14H25ClO4

SMILES

CCCCCCOC(=O)CCCC(=O)OCC(C)Cl

Molecular Weight¹

292.80

• 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	[348.24; 766.63]	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			5.21890e+01
Coefficient B			1.23694e+00
Coefficient C			-5.72200e-04
Coefficient D			4.97000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	348.24	J/mol×K	273.00	Calculated Property
Cp,gas	420.38	J/mol×K	353.78	Calculated Property
Cp,gas	485.73	J/mol×K	434.56	Calculated Property
Cp,gas	544.47	J/mol×K	515.33	Calculated Property
Cp,gas	596.74	J/mol×K	596.11	Calculated Property
Cp,gas	642.70	J/mol×K	676.89	Calculated Property
Cp,gas	682.52	J/mol×K	757.67	Calculated Property
Cp,gas	716.34	J/mol×K	838.44	Calculated Property
Cp,gas	744.32	J/mol×K	919.22	Calculated Property
Cp,gas	766.63	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0031180; 0.0001338]	Pa×s	[347.12; 596.00]	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			-1.33105e+01
Coefficient B			2.61726e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			347.12
Temperature range, max.			596.00
η	0.0031180	Pa×s	347.12	Calculated Property
η	0.0017875	Pa×s	374.77	Calculated Property
η	0.0011062	Pa×s	402.43	Calculated Property
η	0.0007282	Pa×s	430.08	Calculated Property
η	0.0005042	Pa×s	457.73	Calculated Property
η	0.0003640	Pa×s	485.38	Calculated Property
η	0.0002722	Pa×s	513.04	Calculated Property
η	0.0002097	Pa×s	540.69	Calculated Property
η	0.0001657	Pa×s	568.34	Calculated Property
η	0.0001338	Pa×s	596.00	Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2-chloropropyl hexyl ester.

Sources

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

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