Chemical Properties of 4,4'-Dianilino-3,3'-diaminodiphenyl oxide

InChI

InChI=1S/C24H22N4O/c25-21-15-19(11-13-23(21)27-17-7-3-1-4-8-17)29-20-12-14-24(22(26)16-20)28-18-9-5-2-6-10-18/h1-16,27-28H,25-26H2

InChI Key

CVFQPTVXHUGUJS-UHFFFAOYSA-N

Formula

C24H22N4O

SMILES

Nc1cc(Oc2ccc(Nc3ccccc3)c(N)c2)ccc1Nc1ccccc1

Molecular Weight¹

382.47

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• C_p,solid : Solid phase heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• S°_{solid,1 bar} : Solid phase molar entropy at standard conditions (J/mol×K).
• 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, 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.

Temperature Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[384.31; 935.47]	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			-6.12900e+01
Coefficient B			1.94320e+00
Coefficient C			-1.21144e-03
Coefficient D			2.65000e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	384.31	J/mol×K	273.00	Calculated Property
Cp,gas	486.28	J/mol×K	353.78	Calculated Property
Cp,gas	576.12	J/mol×K	434.56	Calculated Property
Cp,gas	654.65	J/mol×K	515.33	Calculated Property
Cp,gas	722.72	J/mol×K	596.11	Calculated Property
Cp,gas	781.17	J/mol×K	676.89	Calculated Property
Cp,gas	830.83	J/mol×K	757.67	Calculated Property
Cp,gas	872.54	J/mol×K	838.44	Calculated Property
Cp,gas	907.14	J/mol×K	919.22	Calculated Property
Cp,gas	935.47	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to 4,4'-Dianilino-3,3'-diaminodiphenyl oxide.

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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