Chemical Properties of 4-Phenoxyphenethylamine (CAS 118468-18-1)

InChI

InChI=1S/C14H15NO/c15-11-10-12-6-8-14(9-7-12)16-13-4-2-1-3-5-13/h1-9H,10-11,15H2

InChI Key

JNHPLGDXCJAUBX-UHFFFAOYSA-N

Formula

C14H15NO

SMILES

NCCc1ccc(Oc2ccccc2)cc1

Molecular Weight¹

213.28

CAS

118468-18-1

• ω : Acentric Factor.
• 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 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
Cp,gas	[459.70; 537.63]	J/mol×K	[673.01; 916.29]
Cp,gas	459.70	J/mol×K	673.01	Joback Calculated Property
Cp,gas	475.55	J/mol×K	713.56	Joback Calculated Property
Cp,gas	490.18	J/mol×K	754.10	Joback Calculated Property
Cp,gas	503.65	J/mol×K	794.65	Joback Calculated Property
Cp,gas	516.01	J/mol×K	835.20	Joback Calculated Property
Cp,gas	527.32	J/mol×K	875.74	Joback Calculated Property
Cp,gas	537.63	J/mol×K	916.29	Joback Calculated Property

Similar Compounds

Find more compounds similar to 4-Phenoxyphenethylamine.

Sources

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

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