Chemical Properties of Hexadecanoic acid, 2-hydroxyethyl ester (CAS 4219-49-2)

InChI

InChI=1S/C18H36O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(20)21-17-16-19/h19H,2-17H2,1H3

InChI Key

BXCRLBBIZJSWNS-UHFFFAOYSA-N

Formula

C18H36O3

SMILES

CCCCCCCCCCCCCCCC(=O)OCCO

Molecular Weight¹

300.48

CAS

4219-49-2

Other Names

• Palmitic acid, 2-hydroxyethyl ester
• Ethylene glycol monopalmitate
• Glycol palmitate
• Palmitoylglycol
• 2-Hydroxyethyl hexadecanoate
• 2-Hydroxyethyl palmitate
• Glycol monopalmitate
• Lanol P
• NSC 406556

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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	1.1267		Relay (1.0) Calculated Property
ΔfG°	-346.51	kJ/mol	Joback Calculated Property
ΔfH°gas	-891.02	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	50.83	kJ/mol	Joback Calculated Property
ΔvapH°	113.09	kJ/mol	Relay (1.0) Calculated Property
IE	10.00	eV	Relay (1.0) Calculated Property
log10WS	-5.39		Relay (1.0) Calculated Property
logPoct/wat	5.003		Crippen Calculated Property
McVol	277.790	ml/mol	McGowan Calculated Property
Pc	1232.01	kPa	Joback Calculated Property
Inp	[2200.00; 2214.00]
Inp	2200.00		NIST
Inp	2214.00		NIST
Inp	2200.00		NIST
Inp	2214.00		NIST
Tboil	614.88	K	Relay (1.0) Calculated Property
Tc	803.15	K	Relay (1.0) Calculated Property
Tfus	320.37	K	Relay (1.0) Calculated Property
Vc	1.074	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[858.63; 948.32]	J/mol×K	[761.84; 934.90]
Cp,gas	858.63	J/mol×K	761.84	Joback Calculated Property
Cp,gas	875.67	J/mol×K	790.68	Joback Calculated Property
Cp,gas	891.85	J/mol×K	819.53	Joback Calculated Property
Cp,gas	907.18	J/mol×K	848.37	Joback Calculated Property
Cp,gas	921.69	J/mol×K	877.21	Joback Calculated Property
Cp,gas	935.39	J/mol×K	906.06	Joback Calculated Property
Cp,gas	948.32	J/mol×K	934.90	Joback Calculated Property
η	[0.0000163; 0.0024149]	Pa×s	[395.77; 761.84]
η	0.0024149	Pa×s	395.77	Joback Calculated Property
η	0.0006023	Pa×s	456.78	Joback Calculated Property
η	0.0002084	Pa×s	517.79	Joback Calculated Property
η	0.0000902	Pa×s	578.80	Joback Calculated Property
η	0.0000458	Pa×s	639.82	Joback Calculated Property
η	0.0000262	Pa×s	700.83	Joback Calculated Property
η	0.0000163	Pa×s	761.84	Joback Calculated Property

Similar Compounds

Find more compounds similar to Hexadecanoic acid, 2-hydroxyethyl ester.

Sources

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

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