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

InChI

InChI=1S/C18H27NO3/c1-3-4-8-14-22-18(21)13-9-12-17(20)19-15(2)16-10-6-5-7-11-16/h5-7,10-11,15H,3-4,8-9,12-14H2,1-2H3,(H,19,20)

InChI Key

HRVIWGGTOKQTTD-UHFFFAOYSA-N

Formula

C18H27NO3

SMILES

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

Molecular Weight¹

305.41

• 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°	-62.80	kJ/mol	Joback Calculated Property
ΔfH°gas	-487.51	kJ/mol	Joback Calculated Property
ΔfusH°	42.38	kJ/mol	Joback Calculated Property
ΔvapH°	79.89	kJ/mol	Joback Calculated Property
log10WS	-4.75		Crippen Calculated Property
logPoct/wat	3.768		Crippen Calculated Property
McVol	259.710	ml/mol	McGowan Calculated Property
Pc	1619.37	kPa	Joback Calculated Property
Inp	[2417.00; 2417.00]
Inp	2417.00		NIST
Inp	2417.00		NIST
Tboil	817.81	K	Joback Calculated Property
Tc	1021.72	K	Joback Calculated Property
Tfus	478.79	K	Joback Calculated Property
Vc	0.995	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[792.02; 870.06]	J/mol×K	[817.81; 1021.72]
Cp,gas	792.02	J/mol×K	817.81	Joback Calculated Property
Cp,gas	807.59	J/mol×K	851.80	Joback Calculated Property
Cp,gas	822.09	J/mol×K	885.78	Joback Calculated Property
Cp,gas	835.54	J/mol×K	919.77	Joback Calculated Property
Cp,gas	848.00	J/mol×K	953.75	Joback Calculated Property
Cp,gas	859.49	J/mol×K	987.74	Joback Calculated Property
Cp,gas	870.06	J/mol×K	1021.72	Joback Calculated Property

Similar Compounds

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

Sources

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

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