Chemical Properties of Glutaric acid, monoamide, N-(3-methylphenyl)-, butyl ester

InChI

InChI=1S/C16H23NO3/c1-3-4-11-20-16(19)10-6-9-15(18)17-14-8-5-7-13(2)12-14/h5,7-8,12H,3-4,6,9-11H2,1-2H3,(H,17,18)

InChI Key

YMYHJKPNNNOJGM-UHFFFAOYSA-N

Formula

C16H23NO3

SMILES

CCCCOC(=O)CCCC(=O)Nc1cccc(C)c1

Molecular Weight¹

277.36

• 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°	-86.83	kJ/mol	Joback Calculated Property
ΔfH°gas	-452.42	kJ/mol	Joback Calculated Property
ΔfusH°	40.33	kJ/mol	Joback Calculated Property
ΔvapH°	76.49	kJ/mol	Joback Calculated Property
log10WS	-3.94		Crippen Calculated Property
logPoct/wat	3.447		Crippen Calculated Property
McVol	231.530	ml/mol	McGowan Calculated Property
Pc	1864.33	kPa	Joback Calculated Property
Inp	[2592.00; 2592.00]
Inp	2592.00		NIST
Inp	2592.00		NIST
Tboil	777.47	K	Joback Calculated Property
Tc	981.54	K	Joback Calculated Property
Tfus	483.77	K	Joback Calculated Property
Vc	0.888	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[676.89; 751.49]	J/mol×K	[777.47; 981.54]
Cp,gas	676.89	J/mol×K	777.47	Joback Calculated Property
Cp,gas	691.69	J/mol×K	811.48	Joback Calculated Property
Cp,gas	705.50	J/mol×K	845.49	Joback Calculated Property
Cp,gas	718.36	J/mol×K	879.50	Joback Calculated Property
Cp,gas	730.30	J/mol×K	913.51	Joback Calculated Property
Cp,gas	741.33	J/mol×K	947.53	Joback Calculated Property
Cp,gas	751.49	J/mol×K	981.54	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, monoamide, N-(3-methylphenyl)-, 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.