Chemical Properties of Hexanamide, N-(2,5-dimethoxyphenyl)-

InChI

InChI=1S/C14H21NO3/c1-4-5-6-7-14(16)15-12-10-11(17-2)8-9-13(12)18-3/h8-10H,4-7H2,1-3H3,(H,15,16)

InChI Key

MRMKRNLOPIUEKH-UHFFFAOYSA-N

Formula

C14H21NO3

SMILES

CCCCCC(=O)Nc1cc(OC)ccc1OC

Molecular Weight¹

251.32

• 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	0.8092		Relay (1.0) Calculated Property
ΔfG°	-89.38	kJ/mol	Joback Calculated Property
ΔfH°gas	-499.54	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	34.35	kJ/mol	Joback Calculated Property
ΔvapH°	87.08	kJ/mol	Relay (1.0) Calculated Property
IE	7.70	eV	Relay (1.0) Calculated Property
log10WS	-3.46		Relay (1.0) Calculated Property
logPoct/wat	3.223		Crippen Calculated Property
McVol	207.650	ml/mol	McGowan Calculated Property
Pc	2030.89	kPa	Joback Calculated Property
Inp	[2062.00; 2062.00]
Inp	2062.00		NIST
Inp	2062.00		NIST
Tboil	609.19	K	Relay (1.0) Calculated Property
Tc	835.39	K	Relay (1.0) Calculated Property
Tfus	371.28	K	Relay (1.0) Calculated Property
Vc	0.761	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[575.79; 653.93]	J/mol×K	[705.24; 906.02]
Cp,gas	575.79	J/mol×K	705.24	Joback Calculated Property
Cp,gas	590.99	J/mol×K	738.70	Joback Calculated Property
Cp,gas	605.31	J/mol×K	772.17	Joback Calculated Property
Cp,gas	618.77	J/mol×K	805.63	Joback Calculated Property
Cp,gas	631.35	J/mol×K	839.10	Joback Calculated Property
Cp,gas	643.07	J/mol×K	872.56	Joback Calculated Property
Cp,gas	653.93	J/mol×K	906.02	Joback Calculated Property

Similar Compounds

Find more compounds similar to Hexanamide, N-(2,5-dimethoxyphenyl)-.

Sources

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

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