Chemical Properties of 4-Benzyloxyaniline (CAS 6373-46-2)

InChI

InChI=1S/C13H13NO/c14-12-6-8-13(9-7-12)15-10-11-4-2-1-3-5-11/h1-9H,10,14H2

InChI Key

FIIDVVUUWRJXLF-UHFFFAOYSA-N

Formula

C13H13NO

SMILES

Nc1ccc(OCc2ccccc2)cc1

Molecular Weight¹

199.25

CAS

6373-46-2

Other Names

• p-Benzyloxyaniline
• Benzenamine, 4-(phenylmethoxy)-
• Aniline, p-(benzyloxy)-
• 4-Aminophenyl benzyl ether

• 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).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfG°	235.22	kJ/mol	Joback Calculated Property
ΔfH°gas	51.51	kJ/mol	Joback Calculated Property
ΔfusH°	23.50	kJ/mol	Joback Calculated Property
ΔvapH°	62.80	kJ/mol	Joback Calculated Property
IE	[7.58; 7.60]	eV
IE	7.58	eV	NIST
IE	7.60	eV	NIST
log10WS	-3.33		Crippen Calculated Property
logPoct/wat	2.848		Crippen Calculated Property
McVol	162.360	ml/mol	McGowan Calculated Property
Pc	3159.72	kPa	Joback Calculated Property
Tboil	650.13	K	Joback Calculated Property
Tc	898.85	K	Joback Calculated Property
Tfus	407.12	K	Joback Calculated Property
Vc	0.595	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[409.06; 484.14]	J/mol×K	[650.13; 898.85]
Cp,gas	409.06	J/mol×K	650.13	Joback Calculated Property
Cp,gas	424.41	J/mol×K	691.58	Joback Calculated Property
Cp,gas	438.54	J/mol×K	733.04	Joback Calculated Property
Cp,gas	451.53	J/mol×K	774.49	Joback Calculated Property
Cp,gas	463.43	J/mol×K	815.94	Joback Calculated Property
Cp,gas	474.28	J/mol×K	857.39	Joback Calculated Property
Cp,gas	484.14	J/mol×K	898.85	Joback Calculated Property

Similar Compounds

Find more compounds similar to 4-Benzyloxyaniline.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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