Chemical Properties of Glutaric acid, monoamide, N-tetradecyl-, propyl ester

InChI

InChI=1S/C22H43NO3/c1-3-5-6-7-8-9-10-11-12-13-14-15-19-23-21(24)17-16-18-22(25)26-20-4-2/h3-20H2,1-2H3,(H,23,24)

InChI Key

YWCZPNKMJNSXCY-UHFFFAOYSA-N

Formula

C22H43NO3

SMILES

CCCCCCCCCCCCCCNC(=O)CCCC(=O)OCCC

Molecular Weight¹

369.58

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• IE : Ionization energy (eV).
• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-953.55	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	63.80	kJ/mol	Joback Calculated Property
ΔvapH°	114.78	kJ/mol	Relay (1.0) Calculated Property
IE	9.12	eV	Relay (1.0) Calculated Property
log10WS	-5.48		Relay (1.0) Calculated Property
logPoct/wat	5.927		Crippen Calculated Property
McVol	339.830	ml/mol	McGowan Calculated Property
Pc	947.33	kPa	Joback Calculated Property
Inp	[2817.00; 2817.00]
Inp	2817.00		NIST
Inp	2817.00		NIST
Tboil	640.82	K	Relay (1.0) Calculated Property
Tc	839.06	K	Relay (1.0) Calculated Property
Tfus	323.75	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[505.63; 1188.35]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			1.44480e+01
Coefficient B			2.08724e+00
Coefficient C			-1.10830e-03
Coefficient D			1.94960e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	505.63	J/mol×K	273.00	Calculated Property
Cp,gas	622.79	J/mol×K	353.78	Calculated Property
Cp,gas	728.18	J/mol×K	434.56	Calculated Property
Cp,gas	822.42	J/mol×K	515.33	Calculated Property
Cp,gas	906.14	J/mol×K	596.11	Calculated Property
Cp,gas	979.94	J/mol×K	676.89	Calculated Property
Cp,gas	1044.45	J/mol×K	757.67	Calculated Property
Cp,gas	1100.27	J/mol×K	838.44	Calculated Property
Cp,gas	1148.03	J/mol×K	919.22	Calculated Property
Cp,gas	1188.35	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, monoamide, N-tetradecyl-, propyl ester.

Sources

• Cheméo Relay (1.0)
• 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.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
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