Chemical Properties of 3-Dimethylaminoanisole (CAS 15799-79-8)

InChI

InChI=1S/C9H13NO/c1-10(2)8-5-4-6-9(7-8)11-3/h4-7H,1-3H3

InChI Key

MOYHVSKDHLMMPS-UHFFFAOYSA-N

Formula

C9H13NO

SMILES

COc1cccc(N(C)C)c1

Molecular Weight¹

151.21

CAS

15799-79-8

Other Names

• 3-Methoxy-N,N-dimethylaniline
• 3-Methoxy-N,N-dimethylbenzenamine

• ω : Acentric Factor.
• PAff : Proton affinity (kJ/mol).
• BasG : Gas basicity (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• 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 for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[172.61; 418.61]	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			-1.00900e+01
Coefficient B			7.81160e-01
Coefficient C			-4.31560e-04
Coefficient D			7.91000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	172.61	J/mol×K	273.00	Calculated Property
Cp,gas	215.76	J/mol×K	353.78	Calculated Property
Cp,gas	254.36	J/mol×K	434.56	Calculated Property
Cp,gas	288.68	J/mol×K	515.33	Calculated Property
Cp,gas	318.97	J/mol×K	596.11	Calculated Property
Cp,gas	345.47	J/mol×K	676.89	Calculated Property
Cp,gas	368.43	J/mol×K	757.67	Calculated Property
Cp,gas	388.11	J/mol×K	838.44	Calculated Property
Cp,gas	404.75	J/mol×K	919.22	Calculated Property
Cp,gas	418.61	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to 3-Dimethylaminoanisole.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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