Chemical Properties of 4-Methylbenzylidene-4-methylaniline (CAS 16979-20-7)

InChI

InChI=1S/C15H15N/c1-12-3-7-14(8-4-12)11-16-15-9-5-13(2)6-10-15/h3-11H,1-2H3

InChI Key

LKMIOABGTREIHR-UHFFFAOYSA-N

Formula

C15H15N

SMILES

Cc1ccc(C=Nc2ccc(C)cc2)cc1

Molecular Weight¹

209.29

CAS

16979-20-7

Other Names

• 4-Methyl-N-[(4-methylphenyl)methylidene]aniline
• (p-Methylbenzylidene)-(4-methylphenyl)-amine
• p-Toluidine, N-(p-methylbenzylidene)-

• ω : Acentric Factor.
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation 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).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.5592		Relay (1.0) Calculated Property
ΔfG°	314.10	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	223.98	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	80.20	kJ/mol	Relay (1.0) Calculated Property
IE	7.77	eV	Relay (1.0) Calculated Property
log10WS	-4.19		Relay (1.0) Calculated Property
logPoct/wat	4.054		Crippen Calculated Property
McVol	180.370	ml/mol	McGowan Calculated Property
Pc	2202.08	kPa	Joback Calculated Property
Inp	[1998.00; 2039.00]
Inp	1998.00		NIST
Inp	2039.00		NIST
Tboil	614.81	K	Relay (1.0) Calculated Property
Tc	846.45	K	Relay (1.0) Calculated Property
Tfus	364.86	K	Relay (1.0) Calculated Property
Vc	0.666	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to 4-Methylbenzylidene-4-methylaniline.

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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