Chemical Properties of Hexadecanoic acid, 3-hydroxy-, methyl ester

InChI

InChI=1S/C17H34O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-16(18)15-17(19)20-2/h16,18H,3-15H2,1-2H3

InChI Key

YBTWUESFQWFDMR-UHFFFAOYSA-N

Formula

C17H34O3

SMILES

CCCCCCCCCCCCCC(O)CC(=O)OC

Molecular Weight¹

286.46

Other Names

• Methyl 3-hydroxyhexadecanoate

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

Physical Properties

Cheméo can also estimate Standard Gibbs free energy of formation for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[394.64; 923.69]	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			1.64530e+01
Coefficient B			1.60394e+00
Coefficient C			-8.40000e-04
Coefficient D			1.43300e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	394.64	J/mol×K	273.00	Calculated Property
Cp,gas	485.10	J/mol×K	353.78	Calculated Property
Cp,gas	566.59	J/mol×K	434.56	Calculated Property
Cp,gas	639.55	J/mol×K	515.33	Calculated Property
Cp,gas	704.44	J/mol×K	596.11	Calculated Property
Cp,gas	761.71	J/mol×K	676.89	Calculated Property
Cp,gas	811.82	J/mol×K	757.67	Calculated Property
Cp,gas	855.22	J/mol×K	838.44	Calculated Property
Cp,gas	892.36	J/mol×K	919.22	Calculated Property
Cp,gas	923.69	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0044173; 0.0000440]	Pa×s	[369.50; 636.73]	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			-1.64054e+01
Coefficient B			4.05829e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			369.50
Temperature range, max.			636.73
η	0.0044173	Pa×s	369.50	Calculated Property
η	0.0019515	Pa×s	399.19	Calculated Property
η	0.0009654	Pa×s	428.88	Calculated Property
η	0.0005231	Pa×s	458.58	Calculated Property
η	0.0003054	Pa×s	488.27	Calculated Property
η	0.0001897	Pa×s	517.96	Calculated Property
η	0.0001240	Pa×s	547.65	Calculated Property
η	0.0000847	Pa×s	577.34	Calculated Property
η	0.0000601	Pa×s	607.04	Calculated Property
η	0.0000440	Pa×s	636.73	Calculated Property

Similar Compounds

Find more compounds similar to Hexadecanoic acid, 3-hydroxy-, methyl ester.

Sources

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

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