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

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[844.03; 884.83]	J/mol×K	[1078.36; 1353.25]
Cp,gas	844.03	J/mol×K	1078.36	Joback Calculated Property
Cp,gas	854.25	J/mol×K	1124.17	Joback Calculated Property
Cp,gas	863.00	J/mol×K	1169.99	Joback Calculated Property
Cp,gas	870.36	J/mol×K	1215.80	Joback Calculated Property
Cp,gas	876.40	J/mol×K	1261.62	Joback Calculated Property
Cp,gas	881.20	J/mol×K	1307.43	Joback Calculated Property
Cp,gas	884.83	J/mol×K	1353.25	Joback Calculated Property
ΔsubH	142.20 ± 2.30	kJ/mol	426.50	NIST

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

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