Chemical Properties of Succinic acid, 2,3-dichlorophenyl (2-methylcyclohex-1-en-1-yl)methyl ester

InChI

InChI=1S/C18H20Cl2O4/c1-12-5-2-3-6-13(12)11-23-16(21)9-10-17(22)24-15-8-4-7-14(19)18(15)20/h4,7-8H,2-3,5-6,9-11H2,1H3

InChI Key

CMNRSCTZNRFRDX-UHFFFAOYSA-N

Formula

C18H20Cl2O4

SMILES

CC1=C(COC(=O)CCC(=O)Oc2cccc(Cl)c2Cl)CCCC1

Molecular Weight¹

371.26

• 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°	43.98	kJ/mol	Joback Calculated Property
logPoct/wat	5.113		Crippen Calculated Property
McVol	264.920	ml/mol	McGowan Calculated Property
Inp	[2861.00; 2861.00]
Inp	2861.00		NIST
Inp	2861.00		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	[352.90; 797.15]	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			2.26530e+01
Coefficient B			1.39352e+00
Coefficient C			-6.93720e-04
Coefficient D			7.47000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	352.90	J/mol×K	273.00	Calculated Property
Cp,gas	432.13	J/mol×K	353.78	Calculated Property
Cp,gas	503.34	J/mol×K	434.56	Calculated Property
Cp,gas	566.77	J/mol×K	515.33	Calculated Property
Cp,gas	622.66	J/mol×K	596.11	Calculated Property
Cp,gas	671.23	J/mol×K	676.89	Calculated Property
Cp,gas	712.73	J/mol×K	757.67	Calculated Property
Cp,gas	747.39	J/mol×K	838.44	Calculated Property
Cp,gas	775.46	J/mol×K	919.22	Calculated Property
Cp,gas	797.15	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0004287; 0.0000606]	Pa×s	[526.00; 771.62]	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			-1.38991e+01
Coefficient B			3.23198e+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.			526.00
Temperature range, max.			771.62
η	0.0004287	Pa×s	526.00	Calculated Property
η	0.0003166	Pa×s	553.29	Calculated Property
η	0.0002406	Pa×s	580.58	Calculated Property
η	0.0001874	Pa×s	607.87	Calculated Property
η	0.0001491	Pa×s	635.16	Calculated Property
η	0.0001209	Pa×s	662.46	Calculated Property
η	0.0000997	Pa×s	689.75	Calculated Property
η	0.0000834	Pa×s	717.04	Calculated Property
η	0.0000707	Pa×s	744.33	Calculated Property
η	0.0000606	Pa×s	771.62	Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2,3-dichlorophenyl (2-methylcyclohex-1-en-1-yl)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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