Chemical Properties of Succinic acid, 2,2-dichloroethyl cis-4-tert-butylcyclohexyl ester

InChI

InChI=1S/C16H26Cl2O4/c1-16(2,3)11-4-6-12(7-5-11)22-15(20)9-8-14(19)21-10-13(17)18/h11-13H,4-10H2,1-3H3

InChI Key

CEQKWDHCYKDKFT-UHFFFAOYSA-N

Formula

C16H26Cl2O4

SMILES

CC(C)(C)C1CCC(OC(=O)CCC(=O)OCC(Cl)Cl)CC1

Molecular Weight¹

353.29

• 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°	36.30	kJ/mol	Joback Calculated Property
logPoct/wat	4.262		Crippen Calculated Property
McVol	264.800	ml/mol	McGowan Calculated Property
Inp	[2267.00; 2267.00]
Inp	2267.00		NIST
Inp	2267.00		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	[366.76; 871.28]	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			-2.08770e+01
Coefficient B			1.65516e+00
Coefficient C			-8.98800e-04
Coefficient D			1.35800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	366.76	J/mol×K	273.00	Calculated Property
Cp,gas	458.20	J/mol×K	353.78	Calculated Property
Cp,gas	539.80	J/mol×K	434.56	Calculated Property
Cp,gas	611.97	J/mol×K	515.33	Calculated Property
Cp,gas	675.16	J/mol×K	596.11	Calculated Property
Cp,gas	729.79	J/mol×K	676.89	Calculated Property
Cp,gas	776.28	J/mol×K	757.67	Calculated Property
Cp,gas	815.08	J/mol×K	838.44	Calculated Property
Cp,gas	846.60	J/mol×K	919.22	Calculated Property
Cp,gas	871.28	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0020136; 0.0000888]	Pa×s	[405.14; 685.15]	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			-1.38447e+01
Coefficient B			3.09402e+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.			405.14
Temperature range, max.			685.15
η	0.0020136	Pa×s	405.14	Calculated Property
η	0.0011680	Pa×s	436.25	Calculated Property
η	0.0007285	Pa×s	467.37	Calculated Property
η	0.0004819	Pa×s	498.48	Calculated Property
η	0.0003346	Pa×s	529.59	Calculated Property
η	0.0002420	Pa×s	560.70	Calculated Property
η	0.0001811	Pa×s	591.82	Calculated Property
η	0.0001394	Pa×s	622.93	Calculated Property
η	0.0001101	Pa×s	654.04	Calculated Property
η	0.0000888	Pa×s	685.15	Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2,2-dichloroethyl cis-4-tert-butylcyclohexyl 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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