Chemical Properties of 1-(Methylamino)anthraquinone (CAS 82-38-2)

InChI

InChI=1S/C15H11NO2/c1-16-12-8-4-7-11-13(12)15(18)10-6-3-2-5-9(10)14(11)17/h2-8,16H,1H3

InChI Key

SVTDYSXXLJYUTM-UHFFFAOYSA-N

Formula

C15H11NO2

SMILES

CNc1cccc2c1C(=O)c1ccccc1C2=O

Molecular Weight¹

237.25

CAS

82-38-2

Other Names

• 1-(N-Methylamino)anthraquinone
• 9,10-Anthracenedione, 1-(methylamino)-
• «alpha»-Methylaminoanthraquinone
• Anthraquinone, 1-(methylamino)-
• C.I. Disperse Red 9
• C.I. Solvent Red 111
• C.I. 60505
• Calco Oil Red ZMQ
• Celanthrene Red Y
• Celliton Pink R
• Diacelliton Fast Pink R
• Disperse Red 9
• Duranol Red GN
• Macro-lex Red G
• Methane quinone
• N-Methyl-1-anthraquinonylamine
• Oil Red ZMQ
• Serilene Fast Pink BT
• Supracet Pink R
• Waxoline Red MAA
• Waxoline Red MP
• 1-(Methylamino)-9,10-anthraquinone
• 1-(N-Methylamino)-9,10-anthraquinone
• Anthraquinone, 1-methylamine
• Amaplast Red AAP
• Kayaset Red G
• Macrolex Red GS
• NSC 3721
• Oracet Red G
• Orient Oil Red 330
• Smoke Red M
• Solvent Red 111

• 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_fusH : Enthalpy of fusion at a given temperature (kJ/mol).
• Δ_subH : Enthalpy of sublimation at a given temperature (kJ/mol).
• Δ_vapH : Enthalpy of vaporization 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

Property	Value	Unit	Temperature (K)	Source
ΔfusH	28.81	kJ/mol	443.20	NIST
ΔsubH	[115.00; 123.80]	kJ/mol	[373.00; 461.00]
ΔsubH	115.90 ± 3.50	kJ/mol	373.00	NIST
ΔsubH	123.80 ± 3.30	kJ/mol	394.50	NIST
ΔsubH	115.00 ± 3.00	kJ/mol	406.00	NIST
ΔsubH	115.50 ± 0.40	kJ/mol	461.00	NIST
ΔvapH	103.50	kJ/mol	463.00	NIST

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[224.94; 553.47]	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			-1.50700e+01
Coefficient B			1.01912e+00
Coefficient C			-5.36080e-04
Coefficient D			8.55000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	224.94	J/mol×K	273.00	Calculated Property
Cp,gas	282.16	J/mol×K	353.78	Calculated Property
Cp,gas	333.58	J/mol×K	434.56	Calculated Property
Cp,gas	379.45	J/mol×K	515.33	Calculated Property
Cp,gas	420.05	J/mol×K	596.11	Calculated Property
Cp,gas	455.66	J/mol×K	676.89	Calculated Property
Cp,gas	486.53	J/mol×K	757.67	Calculated Property
Cp,gas	512.94	J/mol×K	838.44	Calculated Property
Cp,gas	535.17	J/mol×K	919.22	Calculated Property
Cp,gas	553.47	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to 1-(Methylamino)anthraquinone.

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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