Chemical Properties of 3-METHOXYDIPHENYLAMINE

InChI

InChI=1S/C13H13NO/c1-15-13-9-5-8-12(10-13)14-11-6-3-2-4-7-11/h2-10,14H,1H3

InChI Key

MKASXAGBWHIGCF-UHFFFAOYSA-N

Formula

C13H13NO

SMILES

COc1cccc(Nc2ccccc2)c1

Molecular Weight¹

199.25

Other Names

• 3-methoxy-N-phenylaniline
• 3-methoxy-N-phenylbenzenamine
• Benzenamine, 3-methoxy-N-phenyl-
• N-phenyl-m-anisidine

• 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_vapH° : Enthalpy of vaporization at standard conditions (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).
• P_c : Critical Pressure (kPa).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical 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 Volume, 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[200.89; 505.31]	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			-3.81500e+01
Coefficient B			1.03452e+00
Coefficient C			-6.16360e-04
Coefficient D			1.25300e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	200.89	J/mol×K	273.00	Calculated Property
Cp,gas	256.25	J/mol×K	353.78	Calculated Property
Cp,gas	305.30	J/mol×K	434.56	Calculated Property
Cp,gas	348.43	J/mol×K	515.33	Calculated Property
Cp,gas	386.06	J/mol×K	596.11	Calculated Property
Cp,gas	418.56	J/mol×K	676.89	Calculated Property
Cp,gas	446.34	J/mol×K	757.67	Calculated Property
Cp,gas	469.80	J/mol×K	838.44	Calculated Property
Cp,gas	489.32	J/mol×K	919.22	Calculated Property
Cp,gas	505.31	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to 3-METHOXYDIPHENYLAMINE.

Mixtures

• Methyl Alcohol + 3-METHOXYDIPHENYLAMINE
• Ethyl Acetate + 3-METHOXYDIPHENYLAMINE
• Acetone + 3-METHOXYDIPHENYLAMINE
• Ethane, 1,2-dichloro- + 3-METHOXYDIPHENYLAMINE
• Trichloromethane + 3-METHOXYDIPHENYLAMINE

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)
• Crippen Method
• Crippen Method
• Solubilities of 3-Methoxy-N-phenylaniline and 3-(Methylthio)-N-phenylaniline in Five Organic Solvents (285 K to 333.75 K)
• Joback Method
• McGowan Method
• NIST Webbook

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Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
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