Chemical Properties of 9-Octadecenoic acid (Z)-, 2-hydroxyethyl ester (CAS 4500-01-0)

InChI

InChI=1S/C20H38O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(22)23-19-18-21/h9-10,21H,2-8,11-19H2,1H3/b10-9-

InChI Key

MUHFRORXWCGZGE-KTKRTIGZSA-N

Formula

C20H38O3

SMILES

CCCCCCCCC=CCCCCCCCC(=O)OCCO

Molecular Weight¹

326.51

CAS

4500-01-0

Other Names

• Oleic acid, 2-hydroxyethyl ester
• Cithrol A
• Ethylene glycol monooleate
• 2-hydroxyethyl oleate

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• 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

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	[444.59; 1047.35]	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			1.22600e+00
Coefficient B			1.90302e+00
Coefficient C			-1.08380e-03
Coefficient D			2.26900e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	444.59	J/mol×K	273.00	Calculated Property
Cp,gas	548.87	J/mol×K	353.78	Calculated Property
Cp,gas	642.15	J/mol×K	434.56	Calculated Property
Cp,gas	725.15	J/mol×K	515.33	Calculated Property
Cp,gas	798.57	J/mol×K	596.11	Calculated Property
Cp,gas	863.16	J/mol×K	676.89	Calculated Property
Cp,gas	919.60	J/mol×K	757.67	Calculated Property
Cp,gas	968.64	J/mol×K	838.44	Calculated Property
Cp,gas	1010.98	J/mol×K	919.22	Calculated Property
Cp,gas	1047.35	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0015523; 0.0000231]	Pa×s	[413.23; 695.95]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.68235e+01
Coefficient B			4.27919e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			413.23
Temperature range, max.			695.95
η	0.0015523	Pa×s	413.23	Calculated Property
η	0.0007469	Pa×s	444.64	Calculated Property
η	0.0003958	Pa×s	476.06	Calculated Property
η	0.0002269	Pa×s	507.47	Calculated Property
η	0.0001388	Pa×s	538.88	Calculated Property
η	0.0000896	Pa×s	570.30	Calculated Property
η	0.0000606	Pa×s	601.71	Calculated Property
η	0.0000426	Pa×s	633.12	Calculated Property
η	0.0000309	Pa×s	664.54	Calculated Property
η	0.0000231	Pa×s	695.95	Calculated Property

Similar Compounds

Find more compounds similar to 9-Octadecenoic acid (Z)-, 2-hydroxyethyl ester.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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