Chemical Properties of Succinic acid, 2,3-dichlorophenyl hept-1,6-dien-4-yl ester

InChI

InChI=1S/C17H18Cl2O4/c1-3-6-12(7-4-2)22-15(20)10-11-16(21)23-14-9-5-8-13(18)17(14)19/h3-5,8-9,12H,1-2,6-7,10-11H2

InChI Key

LOEHMKZTOUAYQO-UHFFFAOYSA-N

Formula

C17H18Cl2O4

SMILES

C=CCC(CC=C)OC(=O)CCC(=O)Oc1cccc(Cl)c1Cl

Molecular Weight¹

357.23

• 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°	44.10	kJ/mol	Joback Calculated Property
logPoct/wat	4.743		Crippen Calculated Property
McVol	257.390	ml/mol	McGowan Calculated Property
Inp	[2432.00; 2432.00]
Inp	2432.00		NIST
Inp	2432.00		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	[353.51; 748.04]	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			5.10640e+01
Coefficient B			1.29080e+00
Coefficient C			-6.98720e-04
Coefficient D			1.04900e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	353.51	J/mol×K	273.00	Calculated Property
Cp,gas	424.91	J/mol×K	353.78	Calculated Property
Cp,gas	488.65	J/mol×K	434.56	Calculated Property
Cp,gas	545.05	J/mol×K	515.33	Calculated Property
Cp,gas	594.46	J/mol×K	596.11	Calculated Property
Cp,gas	637.19	J/mol×K	676.89	Calculated Property
Cp,gas	673.58	J/mol×K	757.67	Calculated Property
Cp,gas	703.97	J/mol×K	838.44	Calculated Property
Cp,gas	728.68	J/mol×K	919.22	Calculated Property
Cp,gas	748.04	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0007728; 0.0000819]	Pa×s	[458.79; 715.37]	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			-1.34246e+01
Coefficient B			2.87164e+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.			458.79
Temperature range, max.			715.37
η	0.0007728	Pa×s	458.79	Calculated Property
η	0.0005359	Pa×s	487.30	Calculated Property
η	0.0003869	Pa×s	515.81	Calculated Property
η	0.0002890	Pa×s	544.32	Calculated Property
η	0.0002223	Pa×s	572.82	Calculated Property
η	0.0001753	Pa×s	601.33	Calculated Property
η	0.0001412	Pa×s	629.84	Calculated Property
η	0.0001159	Pa×s	658.35	Calculated Property
η	0.0000967	Pa×s	686.86	Calculated Property
η	0.0000819	Pa×s	715.37	Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2,3-dichlorophenyl hept-1,6-dien-4-yl 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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