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

InChI

InChI=1S/C17H25NO3/c1-3-4-13-21-17(20)12-8-11-16(19)18-14(2)15-9-6-5-7-10-15/h5-7,9-10,14H,3-4,8,11-13H2,1-2H3,(H,18,19)

InChI Key

IJPDTHPILMQFOL-UHFFFAOYSA-N

Formula

C17H25NO3

SMILES

CCCCOC(=O)CCCC(=O)NC(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	-4.33		Crippen Calculated Property
logPoct/wat	3.377		Crippen Calculated Property
McVol	245.620	ml/mol	McGowan Calculated Property
Pc	1752.14	kPa	Joback Calculated Property
Inp	[2319.00; 2319.00]
Inp	2319.00		NIST
Inp	2319.00		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-(1-phenylethyl)-, butyl ester.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.