Chemical Properties of Succinic acid, 2,3-dichlorophenyl 3-phenoxybenzyl ester

InChI

InChI=1S/C23H18Cl2O5/c24-19-10-5-11-20(23(19)25)30-22(27)13-12-21(26)28-15-16-6-4-9-18(14-16)29-17-7-2-1-3-8-17/h1-11,14H,12-13,15H2

InChI Key

ZPFLOUGNRLXFNM-UHFFFAOYSA-N

Formula

C23H18Cl2O5

SMILES

O=C(CCC(=O)Oc1cccc(Cl)c1Cl)OCc1cccc(Oc2ccccc2)c1

Molecular Weight¹

445.29

• 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).
• log₁₀WS : Log10 of Water solubility in mol/l.
• 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°	54.60	kJ/mol	Joback Calculated Property
log10WS	-6.88		Relay (1.0) Calculated Property
logPoct/wat	6.215		Crippen Calculated Property
McVol	308.880	ml/mol	McGowan Calculated Property
Inp	[3376.00; 3376.00]
Inp	3376.00		NIST
Inp	3376.00		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 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	[404.17; 892.48]	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			2.52630e+01
Coefficient B			1.61440e+00
Coefficient C			-8.60480e-04
Coefficient D			1.13300e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	404.17	J/mol×K	273.00	Calculated Property
Cp,gas	493.72	J/mol×K	353.78	Calculated Property
Cp,gas	573.62	J/mol×K	434.56	Calculated Property
Cp,gas	644.21	J/mol×K	515.33	Calculated Property
Cp,gas	705.85	J/mol×K	596.11	Calculated Property
Cp,gas	758.92	J/mol×K	676.89	Calculated Property
Cp,gas	803.75	J/mol×K	757.67	Calculated Property
Cp,gas	840.72	J/mol×K	838.44	Calculated Property
Cp,gas	870.18	J/mol×K	919.22	Calculated Property
Cp,gas	892.48	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0001506; 0.0000270]	Pa×s	[632.52; 899.34]	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			-1.45983e+01
Coefficient B			3.66677e+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.			632.52
Temperature range, max.			899.34
η	0.0001506	Pa×s	632.52	Calculated Property
η	0.0001161	Pa×s	662.17	Calculated Property
η	0.0000916	Pa×s	691.81	Calculated Property
η	0.0000737	Pa×s	721.46	Calculated Property
η	0.0000603	Pa×s	751.11	Calculated Property
η	0.0000501	Pa×s	780.76	Calculated Property
η	0.0000422	Pa×s	810.40	Calculated Property
η	0.0000360	Pa×s	840.05	Calculated Property
η	0.0000310	Pa×s	869.70	Calculated Property
η	0.0000270	Pa×s	899.34	Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2,3-dichlorophenyl 3-phenoxybenzyl 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

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