Chemical Properties of 2-Naphthamide, N-butyl-

InChI

InChI=1S/C15H17NO/c1-2-3-10-16-15(17)14-9-8-12-6-4-5-7-13(12)11-14/h4-9,11H,2-3,10H2,1H3,(H,16,17)

InChI Key

IKCJNZVSLPKXLB-UHFFFAOYSA-N

Formula

C15H17NO

SMILES

CCCCN=C(O)c1ccc2ccccc2c1

Molecular Weight¹

227.30

• ω : Acentric Factor.
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• 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	0.8127		Relay (1.0) Calculated Property
ΔfH°gas	-104.20	kJ/mol	Relay (1.0) Calculated Property
IE	8.19	eV	Relay (1.0) Calculated Property
logPoct/wat	3.945		Crippen Calculated Property
McVol	190.540	ml/mol	McGowan Calculated Property
Pc	2256.81	kPa	Joback Calculated Property
Inp	[2214.00; 2214.00]
Inp	2214.00		NIST
Inp	2214.00		NIST
Tboil	653.19	K	Relay (1.0) Calculated Property
Tc	897.65	K	Relay (1.0) Calculated Property
Tfus	385.69	K	Relay (1.0) Calculated Property
Vc	0.684	m3/kmol	Relay (1.0) Calculated Property

Cheméo can also estimate Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Log10 of Water solubility in mol/l 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 2-Naphthamide, N-butyl-.

Sources

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

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