Chemical Properties of cis-5,8,11,14-Eicosatetraenoic acid, 4,4-dimethyloxazoline (dmox) derivative

InChI

InChI=1S/C24H39NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-25-24(2,3)22-26-23/h8-9,11-12,14-15,17-18H,4-7,10,13,16,19-22H2,1-3H3/b9-8-,12-11-,15-14-,18-17-

InChI Key

ZPFSFXNCUITIAF-GKFVBPDJSA-N

Formula

C24H39NO

SMILES

CCCCCC=CCC=CCC=CCC=CCCCC1=NC(C)(C)CO1

Molecular Weight¹

357.57

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	60.31	kJ/mol	Joback Calculated Property
logPoct/wat	7.339		Crippen Calculated Property
McVol	332.510	ml/mol	McGowan Calculated Property
Inp	[2464.10; 2464.10]
Inp	2464.10		NIST
Inp	2464.10		NIST
Tfus	285.60	K	Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l 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	[1081.14; 1211.45]	J/mol×K	[865.67; 1073.28]
Cp,gas	1081.14	J/mol×K	865.67	Joback Calculated Property
Cp,gas	1103.39	J/mol×K	900.27	Joback Calculated Property
Cp,gas	1125.19	J/mol×K	934.87	Joback Calculated Property
Cp,gas	1146.72	J/mol×K	969.48	Joback Calculated Property
Cp,gas	1168.16	J/mol×K	1004.08	Joback Calculated Property
Cp,gas	1189.67	J/mol×K	1038.68	Joback Calculated Property
Cp,gas	1211.45	J/mol×K	1073.28	Joback Calculated Property

Similar Compounds

Find more compounds similar to cis-5,8,11,14-Eicosatetraenoic acid, 4,4-dimethyloxazoline (dmox) derivative.

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.
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