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

InChI

InChI=1S/C18H28Cl2O4/c19-15-7-3-1-5-13(15)11-23-17(21)9-10-18(22)24-12-14-6-2-4-8-16(14)20/h13-16H,1-12H2

InChI Key

CQIPOJANFWACKZ-UHFFFAOYSA-N

Formula

C18H28Cl2O4

SMILES

O=C(CCC(=O)OCC1CCCCC1Cl)OCC1CCCCC1Cl

Molecular Weight¹

379.32

• 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°	45.32	kJ/mol	Joback Calculated Property
logPoct/wat	4.448		Crippen Calculated Property
McVol	282.120	ml/mol	McGowan Calculated Property
Inp	[2885.00; 2885.00]
Inp	2885.00		NIST
Inp	2885.00		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	[375.11; 964.19]	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			-5.62060e+01
Coefficient B			1.80900e+00
Coefficient C			-8.58200e-04
Coefficient D			6.96000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	375.11	J/mol×K	273.00	Calculated Property
Cp,gas	479.45	J/mol×K	353.78	Calculated Property
Cp,gas	573.56	J/mol×K	434.56	Calculated Property
Cp,gas	657.65	J/mol×K	515.33	Calculated Property
Cp,gas	731.94	J/mol×K	596.11	Calculated Property
Cp,gas	796.66	J/mol×K	676.89	Calculated Property
Cp,gas	852.03	J/mol×K	757.67	Calculated Property
Cp,gas	898.26	J/mol×K	838.44	Calculated Property
Cp,gas	935.57	J/mol×K	919.22	Calculated Property
Cp,gas	964.19	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0014988; 0.0001128]	Pa×s	[443.40; 736.80]	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			-1.29996e+01
Coefficient B			2.88056e+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.			443.40
Temperature range, max.			736.80
η	0.0014988	Pa×s	443.40	Calculated Property
η	0.0009605	Pa×s	476.00	Calculated Property
η	0.0006517	Pa×s	508.60	Calculated Property
η	0.0004633	Pa×s	541.20	Calculated Property
η	0.0003424	Pa×s	573.80	Calculated Property
η	0.0002614	Pa×s	606.40	Calculated Property
η	0.0002052	Pa×s	639.00	Calculated Property
η	0.0001648	Pa×s	671.60	Calculated Property
η	0.0001352	Pa×s	704.20	Calculated Property
η	0.0001128	Pa×s	736.80	Calculated Property

Similar Compounds

Find more compounds similar to Succinic 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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