Chemical Properties of Glutaric acid, monoamide, N-(1-phenylethyl)-, hexyl ester

InChI

InChI=1S/C19H29NO3/c1-3-4-5-9-15-23-19(22)14-10-13-18(21)20-16(2)17-11-7-6-8-12-17/h6-8,11-12,16H,3-5,9-10,13-15H2,1-2H3,(H,20,21)

InChI Key

YOJOWOXTYXLILF-UHFFFAOYSA-N

Formula

C19H29NO3

SMILES

CCCCCCOC(=O)CCCC(=O)NC(C)c1ccccc1

Molecular Weight¹

319.44

• 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).
• 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
ΔfG°	-54.38	kJ/mol	Joback Calculated Property
ΔfH°gas	-508.15	kJ/mol	Joback Calculated Property
ΔfusH°	44.97	kJ/mol	Joback Calculated Property
ΔvapH°	82.11	kJ/mol	Joback Calculated Property
log10WS	-5.16		Crippen Calculated Property
logPoct/wat	4.158		Crippen Calculated Property
McVol	273.800	ml/mol	McGowan Calculated Property
Pc	1501.15	kPa	Joback Calculated Property
Inp	[2519.00; 2519.00]
Inp	2519.00		NIST
Inp	2519.00		NIST
Tboil	840.69	K	Joback Calculated Property
Tc	1044.46	K	Joback Calculated Property
Tfus	490.06	K	Joback Calculated Property
Vc	1.050	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[850.20; 929.16]	J/mol×K	[840.69; 1044.46]
Cp,gas	850.20	J/mol×K	840.69	Joback Calculated Property
Cp,gas	865.99	J/mol×K	874.65	Joback Calculated Property
Cp,gas	880.66	J/mol×K	908.61	Joback Calculated Property
Cp,gas	894.28	J/mol×K	942.58	Joback Calculated Property
Cp,gas	906.87	J/mol×K	976.54	Joback Calculated Property
Cp,gas	918.49	J/mol×K	1010.50	Joback Calculated Property
Cp,gas	929.16	J/mol×K	1044.46	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, monoamide, N-(1-phenylethyl)-, hexyl ester.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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