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

InChI

InChI=1S/C22H35NO3/c1-3-4-5-6-7-8-12-18-26-22(25)17-13-16-21(24)23-19(2)20-14-10-9-11-15-20/h9-11,14-15,19H,3-8,12-13,16-18H2,1-2H3,(H,23,24)

InChI Key

HXUXNYLEBGKTGS-UHFFFAOYSA-N

Formula

C22H35NO3

SMILES

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

Molecular Weight¹

361.52

• ω : Acentric Factor.
• 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).
• 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).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.9916		Relay (1.0) Calculated Property
ΔfG°	-29.12	kJ/mol	Joback Calculated Property
ΔfH°gas	-713.56	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	52.74	kJ/mol	Joback Calculated Property
ΔvapH°	116.64	kJ/mol	Relay (1.0) Calculated Property
IE	8.56	eV	Relay (1.0) Calculated Property
log10WS	-4.97		Relay (1.0) Calculated Property
logPoct/wat	5.328		Crippen Calculated Property
McVol	316.070	ml/mol	McGowan Calculated Property
Pc	1214.90	kPa	Joback Calculated Property
Inp	[2809.00; 2809.00]
Inp	2809.00		NIST
Inp	2809.00		NIST
Tboil	646.21	K	Relay (1.0) Calculated Property
Tc	882.11	K	Relay (1.0) Calculated Property
Tfus	334.39	K	Relay (1.0) Calculated Property
Vc	1.164	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1029.29; 1110.79]	J/mol×K	[909.33; 1117.03]
Cp,gas	1029.29	J/mol×K	909.33	Joback Calculated Property
Cp,gas	1045.71	J/mol×K	943.95	Joback Calculated Property
Cp,gas	1060.93	J/mol×K	978.56	Joback Calculated Property
Cp,gas	1074.99	J/mol×K	1013.18	Joback Calculated Property
Cp,gas	1087.95	J/mol×K	1047.80	Joback Calculated Property
Cp,gas	1099.87	J/mol×K	1082.41	Joback Calculated Property
Cp,gas	1110.79	J/mol×K	1117.03	Joback Calculated Property

Similar Compounds

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