Chemical Properties of Benzeneethanamine, N-(phenylmethylene)-

InChI

InChI=1S/C15H15N/c1-3-7-14(8-4-1)11-12-16-13-15-9-5-2-6-10-15/h1-10,13H,11-12H2

InChI Key

OOBAKFDIGIHHOM-UHFFFAOYSA-N

Formula

C15H15N

SMILES

C(=NCCc1ccccc1)c1ccccc1

Molecular Weight¹

209.29

Other Names

• Phenethylamine, N-benzylidene-
• N-Benzylidene-«beta»-phenethylamine
• N-Benzylidene-«beta»-phenylethylamine
• N-Benzylidene phenylethylamine

• Δ_fH°_gas : Enthalpy of formation 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).
• I : Polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	266.53	kJ/mol	Relay (1.0) Calculated Property
IE	8.69	eV	Relay (1.0) Calculated Property
log10WS	-2.99		Relay (1.0) Calculated Property
logPoct/wat	3.348		Crippen Calculated Property
McVol	180.370	ml/mol	McGowan Calculated Property
I	[2560.00; 2560.00]
I	2560.00		NIST
I	2560.00		NIST
Tboil	602.14	K	Relay (1.0) Calculated Property
Tfus	293.06	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of vaporization at standard conditions, 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.

Similar Compounds

Find more compounds similar to Benzeneethanamine, N-(phenylmethylene)-.

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
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