Chemical Properties of 1-Amino-2-methyl-4-p-toluidinoanthraquinone

InChI

InChI=1S/C22H18N2O2/c1-12-7-9-14(10-8-12)24-17-11-13(2)20(23)19-18(17)21(25)15-5-3-4-6-16(15)22(19)26/h3-11,24H,23H2,1-2H3

InChI Key

BYGSHXHLDPUXIF-UHFFFAOYSA-N

Formula

C22H18N2O2

SMILES

Cc1ccc(Nc2cc(C)c(N)c3c2C(=O)c2ccccc2C3=O)cc1

Molecular Weight¹

342.40

Other Names

• 1-amino-2-methyl-4-[(4-methylphenyl)amino]anthraquinone
• 1-Amino-2-methyl-4-[(4-methylphenyl)amino]-9,10-anthraquinone

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_subH : Enthalpy of sublimation at a given temperature (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, 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	[344.20; 822.93]	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			-5.95000e+00
Coefficient B			1.48864e+00
Coefficient C			-7.90360e-04
Coefficient D			1.30600e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	344.20	J/mol×K	273.00	Calculated Property
Cp,gas	427.56	J/mol×K	353.78	Calculated Property
Cp,gas	502.41	J/mol×K	434.56	Calculated Property
Cp,gas	569.17	J/mol×K	515.33	Calculated Property
Cp,gas	628.26	J/mol×K	596.11	Calculated Property
Cp,gas	680.07	J/mol×K	676.89	Calculated Property
Cp,gas	725.03	J/mol×K	757.67	Calculated Property
Cp,gas	763.56	J/mol×K	838.44	Calculated Property
Cp,gas	796.05	J/mol×K	919.22	Calculated Property
Cp,gas	822.93	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to 1-Amino-2-methyl-4-p-toluidinoanthraquinone.

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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