Chemical Properties of Acetamide, N-(1-naphthyl)-2-(2-thienyl)-

InChI

InChI=1S/C16H13NOS/c18-16(11-13-7-4-10-19-13)17-15-9-3-6-12-5-1-2-8-14(12)15/h1-10H,11H2,(H,17,18)

InChI Key

FKIHEFZFNZEICZ-UHFFFAOYSA-N

Formula

C16H13NOS

SMILES

O=C(Cc1cccs1)Nc1cccc2ccccc12

Molecular Weight¹

267.35

• 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	0.6306		Relay (1.0) Calculated Property
ΔfG°	247.53	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	77.60	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	108.42	kJ/mol	Relay (1.0) Calculated Property
IE	7.79	eV	Relay (1.0) Calculated Property
log10WS	-3.89		Relay (1.0) Calculated Property
logPoct/wat	4.082		Crippen Calculated Property
McVol	201.520	ml/mol	McGowan Calculated Property
Pc	3770.37	kPa	Relay (1.0-beta) Calculated Property
Inp	[2498.00; 2498.00]
Inp	2498.00		NIST
Inp	2498.00		NIST
Tboil	670.54	K	Relay (1.0) Calculated Property
Tc	1007.72	K	Relay (1.0) Calculated Property
Tfus	422.25	K	Relay (1.0) Calculated Property
Vc	0.720	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to Acetamide, N-(1-naphthyl)-2-(2-thienyl)-.

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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