Chemical Properties of 9,10-Anthracenedione, 1,4-bis(methylamino)-

InChI

InChI=1S/C16H14N2O2/c1-17-11-7-8-12(18-2)14-13(11)15(19)9-5-3-4-6-10(9)16(14)20/h3-8,17-18H,1-2H3

InChI Key

QOSTVEDABRQTSU-UHFFFAOYSA-N

Formula

C16H14N2O2

SMILES

CNc1ccc(NC)c2c1C(=O)c1ccccc1C2=O

Molecular Weight¹

266.30

Other Names

• 1,4-Bis(N-methylamino)anthraquinone
• 1,4-Bis(methylamino)-9,10-anthracenedione
• 1,4-Bis(methylamino)-9,10-anthraquinone
• 1,4-bis(N-methylamino)anthra-9,10-quinone
• 1,4-bis(methylamino)anthraquinone
• Acetate Blue B
• Anthraquinone, 1,4-bis(methylamino)-
• Artisil Blue BRP
• C.I. 61500
• C.I. Disperse Blue 110
• C.I. Disperse Blue 14
• C.I. Disperse Blue 78
• C.I. Solvent Blue 78
• C.I. Solvent Blue 93
• Celliton Fast Blue B
• Cibacet Blue BR
• Cilla Fast Blue B
• Diaresin Blue K
• Disperse Blue 110
• Disperse Blue 78
• Duranol Brilliant Blue G
• Macrolex Blue FR
• NSC 86161
• Resiren Blue TB
• Serisol Brilliant Blue G
• Setacyl Blue BS
• Solvent Blue 78
• Solvent Blue 93
• Supracet Fast Blue 2G
• Teraprint Blue R
• disperse blue 14

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_subH : Enthalpy of sublimation at a given temperature (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• 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 vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor 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	[264.88; 638.91]	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			-2.89000e+00
Coefficient B			1.13084e+00
Coefficient C			-5.72040e-04
Coefficient D			8.30000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	264.88	J/mol×K	273.00	Calculated Property
Cp,gas	329.26	J/mol×K	353.78	Calculated Property
Cp,gas	387.31	J/mol×K	434.56	Calculated Property
Cp,gas	439.31	J/mol×K	515.33	Calculated Property
Cp,gas	485.52	J/mol×K	596.11	Calculated Property
Cp,gas	526.21	J/mol×K	676.89	Calculated Property
Cp,gas	561.63	J/mol×K	757.67	Calculated Property
Cp,gas	592.04	J/mol×K	838.44	Calculated Property
Cp,gas	617.71	J/mol×K	919.22	Calculated Property
Cp,gas	638.91	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to 9,10-Anthracenedione, 1,4-bis(methylamino)-.

Mixtures

• Carbon dioxide + 9,10-Anthracenedione, 1,4-bis(methylamino)-
• Methyl Alcohol + 9,10-Anthracenedione, 1,4-bis(methylamino)-
• Ethanol + 9,10-Anthracenedione, 1,4-bis(methylamino)-

Sources

• Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) ChEDL chemicals 1.5.2, from Bradley, J.-C.; Williams, A.; Lang, A. Jean-Claude Bradley Open Melting Point Dataset. Figshare, 2014 (CC0).
• 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
• Measurement of binary diffusion coefficient and solubility estimation for dyes in supercritical carbon dioxide by CIR method
• Solubilities of a 1,4-Bis(alkylamino)-9,10-anthraquinone Series in Compressed Carbon Dioxide
• Joback Method
• McGowan Method
• NIST Webbook

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