Chemical Properties of Succinic acid, 2,2-dichloroethyl 2,3-dimethylphenyl ester

InChI

InChI=1S/C14H16Cl2O4/c1-9-4-3-5-11(10(9)2)20-14(18)7-6-13(17)19-8-12(15)16/h3-5,12H,6-8H2,1-2H3

InChI Key

IWBYHJNVSMTXTJ-UHFFFAOYSA-N

Formula

C14H16Cl2O4

SMILES

Cc1cccc(OC(=O)CCC(=O)OCC(Cl)Cl)c1C

Molecular Weight¹

319.18

• 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°	38.89	kJ/mol	Joback Calculated Property
logPoct/wat	3.336		Crippen Calculated Property
McVol	223.720	ml/mol	McGowan Calculated Property
Inp	[2255.00; 2255.00]
Inp	2255.00		NIST
Inp	2255.00		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	[309.49; 650.29]	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			5.97730e+01
Coefficient B			1.04584e+00
Coefficient C			-4.89720e-04
Coefficient D			3.44000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	309.49	J/mol×K	273.00	Calculated Property
Cp,gas	370.00	J/mol×K	353.78	Calculated Property
Cp,gas	424.59	J/mol×K	434.56	Calculated Property
Cp,gas	473.38	J/mol×K	515.33	Calculated Property
Cp,gas	516.48	J/mol×K	596.11	Calculated Property
Cp,gas	553.98	J/mol×K	676.89	Calculated Property
Cp,gas	586.01	J/mol×K	757.67	Calculated Property
Cp,gas	612.66	J/mol×K	838.44	Calculated Property
Cp,gas	634.05	J/mol×K	919.22	Calculated Property
Cp,gas	650.29	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0010408; 0.0001042]	Pa×s	[428.50; 672.32]	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			-1.32142e+01
Coefficient B			2.71948e+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.			428.50
Temperature range, max.			672.32
η	0.0010408	Pa×s	428.50	Calculated Property
η	0.0007137	Pa×s	455.59	Calculated Property
η	0.0005105	Pa×s	482.68	Calculated Property
η	0.0003784	Pa×s	509.77	Calculated Property
η	0.0002891	Pa×s	536.86	Calculated Property
η	0.0002267	Pa×s	563.95	Calculated Property
η	0.0001817	Pa×s	591.05	Calculated Property
η	0.0001485	Pa×s	618.14	Calculated Property
η	0.0001235	Pa×s	645.23	Calculated Property
η	0.0001042	Pa×s	672.32	Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2,2-dichloroethyl 2,3-dimethylphenyl 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.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
These property values are available through the Cheméo API. A free account gives you an access key.