Chemical Properties of Succinic acid, 2,3-dichlorophenyl 4-chlorobenzyl ester

InChI

InChI=1S/C17H13Cl3O4/c18-12-6-4-11(5-7-12)10-23-15(21)8-9-16(22)24-14-3-1-2-13(19)17(14)20/h1-7H,8-10H2

InChI Key

RCHRFPNYADUPAD-UHFFFAOYSA-N

Formula

C17H13Cl3O4

SMILES

O=C(CCC(=O)Oc1cccc(Cl)c1Cl)OCc1ccc(Cl)cc1

Molecular Weight¹

387.65

• 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°	48.03	kJ/mol	Joback Calculated Property
logPoct/wat	5.076		Crippen Calculated Property
McVol	254.470	ml/mol	McGowan Calculated Property
Inp	[2968.00; 2968.00]
Inp	2968.00		NIST
Inp	2968.00		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	[332.14; 691.23]	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			5.20130e+01
Coefficient B			1.19330e+00
Coefficient C			-6.34280e-04
Coefficient D			8.02000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	332.14	J/mol×K	273.00	Calculated Property
Cp,gas	398.34	J/mol×K	353.78	Calculated Property
Cp,gas	457.37	J/mol×K	434.56	Calculated Property
Cp,gas	509.49	J/mol×K	515.33	Calculated Property
Cp,gas	554.95	J/mol×K	596.11	Calculated Property
Cp,gas	594.00	J/mol×K	676.89	Calculated Property
Cp,gas	626.91	J/mol×K	757.67	Calculated Property
Cp,gas	653.91	J/mol×K	838.44	Calculated Property
Cp,gas	675.27	J/mol×K	919.22	Calculated Property
Cp,gas	691.23	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0003864; 0.0000675]	Pa×s	[546.17; 786.51]	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			-1.35669e+01
Coefficient B			3.11762e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			546.17
Temperature range, max.			786.51
η	0.0003864	Pa×s	546.17	Calculated Property
η	0.0002961	Pa×s	572.87	Calculated Property
η	0.0002324	Pa×s	599.58	Calculated Property
η	0.0001862	Pa×s	626.28	Calculated Property
η	0.0001519	Pa×s	652.99	Calculated Property
η	0.0001259	Pa×s	679.69	Calculated Property
η	0.0001058	Pa×s	706.40	Calculated Property
η	0.0000901	Pa×s	733.10	Calculated Property
η	0.0000776	Pa×s	759.81	Calculated Property
η	0.0000675	Pa×s	786.51	Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2,3-dichlorophenyl 4-chlorobenzyl 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.
These property values are available through the Cheméo API. A free account gives you an access key.