Chemical Properties of Glutaric acid, monoamide, N-(2-phenylpropyl)-, propyl ester

InChI

InChI=1S/C17H25NO3/c1-3-12-21-17(20)11-7-10-16(19)18-13-14(2)15-8-5-4-6-9-15/h4-6,8-9,14H,3,7,10-13H2,1-2H3,(H,18,19)

InChI Key

ACHOOMBRYHOMCZ-UHFFFAOYSA-N

Formula

C17H25NO3

SMILES

CCCOC(=O)CCCC(=O)NCC(C)c1ccccc1

Molecular Weight¹

291.39

• 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°	-71.22	kJ/mol	Joback Calculated Property
ΔfH°gas	-466.87	kJ/mol	Joback Calculated Property
ΔfusH°	39.79	kJ/mol	Joback Calculated Property
ΔvapH°	77.66	kJ/mol	Joback Calculated Property
log10WS	-3.83		Crippen Calculated Property
logPoct/wat	3.030		Crippen Calculated Property
McVol	245.620	ml/mol	McGowan Calculated Property
Pc	1752.14	kPa	Joback Calculated Property
Inp	[2331.00; 2331.00]
Inp	2331.00		NIST
Inp	2331.00		NIST
Tboil	794.93	K	Joback Calculated Property
Tc	999.63	K	Joback Calculated Property
Tfus	467.52	K	Joback Calculated Property
Vc	0.939	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[734.70; 811.71]	J/mol×K	[794.93; 999.63]
Cp,gas	734.70	J/mol×K	794.93	Joback Calculated Property
Cp,gas	750.05	J/mol×K	829.05	Joback Calculated Property
Cp,gas	764.34	J/mol×K	863.16	Joback Calculated Property
Cp,gas	777.62	J/mol×K	897.28	Joback Calculated Property
Cp,gas	789.92	J/mol×K	931.39	Joback Calculated Property
Cp,gas	801.27	J/mol×K	965.51	Joback Calculated Property
Cp,gas	811.71	J/mol×K	999.63	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, monoamide, N-(2-phenylpropyl)-, propyl ester.

Sources

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

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