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

InChI

InChI=1S/C27H45NO3/c1-3-4-5-6-7-8-9-10-11-12-13-17-23-31-27(30)22-18-21-26(29)28-24(2)25-19-15-14-16-20-25/h14-16,19-20,24H,3-13,17-18,21-23H2,1-2H3,(H,28,29)

InChI Key

BFLKRBWWPOAYMV-UHFFFAOYSA-N

Formula

C27H45NO3

SMILES

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

Molecular Weight¹

431.65

• 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°	12.98	kJ/mol	Joback Calculated Property
ΔfH°gas	-673.27	kJ/mol	Joback Calculated Property
ΔfusH°	65.69	kJ/mol	Joback Calculated Property
ΔvapH°	99.92	kJ/mol	Joback Calculated Property
log10WS	-8.51		Crippen Calculated Property
logPoct/wat	7.278		Crippen Calculated Property
McVol	386.520	ml/mol	McGowan Calculated Property
Pc	891.60	kPa	Joback Calculated Property
Inp	[3338.00; 3338.00]
Inp	3338.00		NIST
Inp	3338.00		NIST
Tboil	1023.73	K	Joback Calculated Property
Tc	1256.06	K	Joback Calculated Property
Tfus	580.22	K	Joback Calculated Property
Vc	1.498	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1339.56; 1426.54]	J/mol×K	[1023.73; 1256.06]
Cp,gas	1339.56	J/mol×K	1023.73	Joback Calculated Property
Cp,gas	1357.57	J/mol×K	1062.45	Joback Calculated Property
Cp,gas	1374.04	J/mol×K	1101.17	Joback Calculated Property
Cp,gas	1389.08	J/mol×K	1139.89	Joback Calculated Property
Cp,gas	1402.78	J/mol×K	1178.62	Joback Calculated Property
Cp,gas	1415.24	J/mol×K	1217.34	Joback Calculated Property
Cp,gas	1426.54	J/mol×K	1256.06	Joback Calculated Property

Similar Compounds

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

Sources

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

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