Chemical Properties of Pyridine, 5-phenyl-2-propyl

InChI

InChI=1S/C14H15N/c1-2-6-14-10-9-13(11-15-14)12-7-4-3-5-8-12/h3-5,7-11H,2,6H2,1H3

InChI Key

BVDPEOPUDQPYDO-UHFFFAOYSA-N

Formula

C14H15N

SMILES

CCCc1ccc(-c2ccccc2)cn1

Molecular Weight¹

197.28

• 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	0.4979		Relay (1.0) Calculated Property
ΔfG°	291.33	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	163.73	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	77.39	kJ/mol	Relay (1.0) Calculated Property
IE	8.49	eV	Relay (1.0) Calculated Property
log10WS	-3.21		Relay (1.0) Calculated Property
logPoct/wat	3.701		Crippen Calculated Property
McVol	170.580	ml/mol	McGowan Calculated Property
Pc	2683.25	kPa	Relay (1.0-beta) Calculated Property
Inp	[1684.00; 1685.00]
Inp	1684.00		NIST
Inp	1685.00		NIST
Tboil	582.27	K	Relay (1.0) Calculated Property
Tc	809.89	K	Relay (1.0) Calculated Property
Tfus	303.38	K	Relay (1.0) Calculated Property
Vc	0.639	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to Pyridine, 5-phenyl-2-propyl.

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
• McGowan Method
• NIST Webbook

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