Chemical Properties of N-Benzyllinoleamide

InChI

InChI=1S/C25H39NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-25(27)26-23-24-20-17-16-18-21-24/h6-7,9-10,16-18,20-21H,2-5,8,11-15,19,22-23H2,1H3,(H,26,27)/b7-6+,10-9+

InChI Key

YJWLCIANOBCQGW-HZJYTTRNSA-N

Formula

C25H39NO

SMILES

CCCCC/C=C\C/C=C\CCCCCCCC(=O)NCc1ccccc1

Molecular Weight¹

369.59

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• 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
ΔfusH°	61.65	kJ/mol	Joback Calculated Property
ΔvapH°	133.76	kJ/mol	Relay (1.0) Calculated Property
log10WS	-6.22		Relay (1.0) Calculated Property
logPoct/wat	7.116		Crippen Calculated Property
McVol	342.300	ml/mol	McGowan Calculated Property
Inp	[3063.60; 3063.60]
Inp	3063.60		NIST
Inp	3063.60		NIST
Tboil	662.56	K	Relay (1.0) Calculated Property
Tc	902.82	K	Relay (1.0) Calculated Property
Tfus	294.76	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1109.19; 1208.21]	J/mol×K	[910.64; 1118.07]
Cp,gas	1109.19	J/mol×K	910.64	Joback Calculated Property
Cp,gas	1127.80	J/mol×K	945.21	Joback Calculated Property
Cp,gas	1145.43	J/mol×K	979.78	Joback Calculated Property
Cp,gas	1162.18	J/mol×K	1014.36	Joback Calculated Property
Cp,gas	1178.16	J/mol×K	1048.93	Joback Calculated Property
Cp,gas	1193.47	J/mol×K	1083.50	Joback Calculated Property
Cp,gas	1208.21	J/mol×K	1118.07	Joback Calculated Property

Similar Compounds

Find more compounds similar to N-Benzyllinoleamide.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• 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.
These property values are available through the Cheméo API. A free account gives you an access key.