Chemical Properties of Succinic acid, 2-methylpent-3-yl 3,5-dichlorophenyl ester

InChI

InChI=1S/C16H20Cl2O4/c1-4-14(10(2)3)22-16(20)6-5-15(19)21-13-8-11(17)7-12(18)9-13/h7-10,14H,4-6H2,1-3H3

InChI Key

BZTMVORHEXOIIG-UHFFFAOYSA-N

Formula

C16H20Cl2O4

SMILES

CCC(OC(=O)CCC(=O)Oc1cc(Cl)cc(Cl)c1)C(C)C

Molecular Weight¹

347.23

• 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°	40.55	kJ/mol	Joback Calculated Property
logPoct/wat	4.657		Crippen Calculated Property
McVol	251.900	ml/mol	McGowan Calculated Property
Inp	[2249.00; 2249.00]
Inp	2249.00		NIST
Inp	2249.00		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	[351.60; 754.01]	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			5.62730e+01
Coefficient B			1.24176e+00
Coefficient C			-6.01720e-04
Coefficient D			5.77000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	351.60	J/mol×K	273.00	Calculated Property
Cp,gas	422.82	J/mol×K	353.78	Calculated Property
Cp,gas	486.99	J/mol×K	434.56	Calculated Property
Cp,gas	544.29	J/mol×K	515.33	Calculated Property
Cp,gas	594.90	J/mol×K	596.11	Calculated Property
Cp,gas	639.01	J/mol×K	676.89	Calculated Property
Cp,gas	676.79	J/mol×K	757.67	Calculated Property
Cp,gas	708.43	J/mol×K	838.44	Calculated Property
Cp,gas	734.11	J/mol×K	919.22	Calculated Property
Cp,gas	754.01	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0010012; 0.0000769]	Pa×s	[436.04; 703.10]	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			-1.36620e+01
Coefficient B			2.94562e+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.			436.04
Temperature range, max.			703.10
η	0.0010012	Pa×s	436.04	Calculated Property
η	0.0006510	Pa×s	465.71	Calculated Property
η	0.0004457	Pa×s	495.39	Calculated Property
η	0.0003185	Pa×s	525.06	Calculated Property
η	0.0002359	Pa×s	554.73	Calculated Property
η	0.0001802	Pa×s	584.40	Calculated Property
η	0.0001412	Pa×s	614.08	Calculated Property
η	0.0001132	Pa×s	643.75	Calculated Property
η	0.0000925	Pa×s	673.42	Calculated Property
η	0.0000769	Pa×s	703.10	Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2-methylpent-3-yl 3,5-dichlorophenyl 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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