Chemical Properties of 2,4-Thiazolidinedione, 5-p-chlorobenzylidene-

InChI

InChI=1S/C10H6ClNO2S/c11-7-3-1-6(2-4-7)5-8-9(13)12-10(14)15-8/h1-5H,(H,12,13,14)/b8-5+

InChI Key

OTTGINRZTJUWBT-VMPITWQZSA-N

Formula

C10H6ClNO2S

SMILES

O=C1NC(=O)/C(=C\c2ccc(Cl)cc2)S1

Molecular Weight¹

239.68

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate 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, 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	[187.53; 420.41]	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			4.33600e+01
Coefficient B			5.67310e-01
Coefficient C			-1.26160e-04
Coefficient D			-6.41000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	187.53	J/mol×K	273.00	Calculated Property
Cp,gas	225.43	J/mol×K	353.78	Calculated Property
Cp,gas	260.80	J/mol×K	434.56	Calculated Property
Cp,gas	293.44	J/mol×K	515.33	Calculated Property
Cp,gas	323.13	J/mol×K	596.11	Calculated Property
Cp,gas	349.68	J/mol×K	676.89	Calculated Property
Cp,gas	372.89	J/mol×K	757.67	Calculated Property
Cp,gas	392.55	J/mol×K	838.44	Calculated Property
Cp,gas	408.46	J/mol×K	919.22	Calculated Property
Cp,gas	420.41	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to 2,4-Thiazolidinedione, 5-p-chlorobenzylidene-.

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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