Chemical Properties of Glutaric acid, di((2-chlorocyclohexyl)methyl) ester

InChI

InChI=1S/C19H30Cl2O4/c20-16-8-3-1-6-14(16)12-24-18(22)10-5-11-19(23)25-13-15-7-2-4-9-17(15)21/h14-17H,1-13H2

InChI Key

GEHMIUGYRSJLQN-UHFFFAOYSA-N

Formula

C19H30Cl2O4

SMILES

O=C(CCCC(=O)OCC1CCCCC1Cl)OCC1CCCCC1Cl

Molecular Weight¹

393.35

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	47.91	kJ/mol	Joback Calculated Property
logPoct/wat	4.838		Crippen Calculated Property
McVol	296.210	ml/mol	McGowan Calculated Property
Inp	[2952.00; 2952.00]
Inp	2952.00		NIST
Inp	2952.00		NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l 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	[396.32; 1015.78]	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			-5.71150e+01
Coefficient B			1.90400e+00
Coefficient C			-9.12600e-04
Coefficient D			8.15000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	396.32	J/mol×K	273.00	Calculated Property
Cp,gas	505.87	J/mol×K	353.78	Calculated Property
Cp,gas	604.63	J/mol×K	434.56	Calculated Property
Cp,gas	692.88	J/mol×K	515.33	Calculated Property
Cp,gas	770.85	J/mol×K	596.11	Calculated Property
Cp,gas	838.82	J/mol×K	676.89	Calculated Property
Cp,gas	897.04	J/mol×K	757.67	Calculated Property
Cp,gas	945.77	J/mol×K	838.44	Calculated Property
Cp,gas	985.27	J/mol×K	919.22	Calculated Property
Cp,gas	1015.79	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0013338; 0.0001006]	Pa×s	[454.67; 751.61]	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			-1.31623e+01
Coefficient B			2.97472e+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.			454.67
Temperature range, max.			751.61
η	0.0013338	Pa×s	454.67	Calculated Property
η	0.0008568	Pa×s	487.66	Calculated Property
η	0.0005821	Pa×s	520.66	Calculated Property
η	0.0004141	Pa×s	553.65	Calculated Property
η	0.0003061	Pa×s	586.64	Calculated Property
η	0.0002337	Pa×s	619.64	Calculated Property
η	0.0001833	Pa×s	652.63	Calculated Property
η	0.0001472	Pa×s	685.63	Calculated Property
η	0.0001206	Pa×s	718.62	Calculated Property
η	0.0001006	Pa×s	751.61	Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, di((2-chlorocyclohexyl)methyl) 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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
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