Chemical Properties of Hexanamide, N-ethyl-N-(3-methylphenyl)-6-chloro-

InChI

InChI=1S/C15H22ClNO/c1-3-17(14-9-7-8-13(2)12-14)15(18)10-5-4-6-11-16/h7-9,12H,3-6,10-11H2,1-2H3

InChI Key

XOQPJEQXXHERBD-UHFFFAOYSA-N

Formula

C15H22ClNO

SMILES

CCN(C(=O)CCCCCCl)c1cccc(C)c1

Molecular Weight¹

267.79

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• 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).
• 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	0.7343		Relay (1.0) Calculated Property
ΔfG°	148.13	kJ/mol	Joback Calculated Property
ΔfH°gas	-290.12	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	37.07	kJ/mol	Joback Calculated Property
ΔvapH°	86.74	kJ/mol	Relay (1.0) Calculated Property
IE	8.36	eV	Relay (1.0) Calculated Property
log10WS	-4.12		Relay (1.0) Calculated Property
logPoct/wat	4.147		Crippen Calculated Property
McVol	222.240	ml/mol	McGowan Calculated Property
Pc	1861.11	kPa	Joback Calculated Property
Inp	[1934.00; 1934.00]
Inp	1934.00		NIST
Inp	1934.00		NIST
Tboil	607.55	K	Relay (1.0) Calculated Property
Tc	836.93	K	Relay (1.0) Calculated Property
Tfus	320.26	K	Relay (1.0) Calculated Property
Vc	0.799	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[587.50; 670.61]	J/mol×K	[678.00; 879.41]
Cp,gas	587.50	J/mol×K	678.00	Joback Calculated Property
Cp,gas	603.63	J/mol×K	711.57	Joback Calculated Property
Cp,gas	618.79	J/mol×K	745.14	Joback Calculated Property
Cp,gas	633.02	J/mol×K	778.71	Joback Calculated Property
Cp,gas	646.37	J/mol×K	812.28	Joback Calculated Property
Cp,gas	658.89	J/mol×K	845.85	Joback Calculated Property
Cp,gas	670.61	J/mol×K	879.41	Joback Calculated Property

Similar Compounds

Find more compounds similar to Hexanamide, N-ethyl-N-(3-methylphenyl)-6-chloro-.

Sources

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

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