Chemical Properties of Tetracosanoic acid, propyl ester

InChI

InChI=1S/C27H54O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-27(28)29-26-4-2/h3-26H2,1-2H3

InChI Key

KNLZZQYOTJRNTD-UHFFFAOYSA-N

Formula

C27H54O2

SMILES

CCCCCCCCCCCCCCCCCCCCCCCC(=O)OCCC

Molecular Weight¹

410.72

Other Names

• propyl tetracosanoate

• 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).
• 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	1.2183		Relay (1.0) Calculated Property
ΔfH°gas	-919.51	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	70.06	kJ/mol	Joback Calculated Property
ΔvapH°	130.04	kJ/mol	Relay (1.0) Calculated Property
IE	9.95	eV	Relay (1.0) Calculated Property
log10WS	-8.99		Relay (1.0) Calculated Property
logPoct/wat	9.542		Crippen Calculated Property
McVol	398.730	ml/mol	McGowan Calculated Property
Pc	690.70	kPa	Joback Calculated Property
Inp	[2877.44; 2877.44]
Inp	2877.44		NIST
Inp	2877.44		NIST
Tboil	639.22	K	Relay (1.0) Calculated Property
Tc	824.90	K	Relay (1.0) Calculated Property
Tfus	316.80	K	Relay (1.0) Calculated Property
Vc	1.575	m3/kmol	Relay (1.0) Calculated Property

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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1339.55; 1460.05]	J/mol×K	[875.58; 1074.91]
Cp,gas	1339.55	J/mol×K	875.58	Joback Calculated Property
Cp,gas	1363.10	J/mol×K	908.80	Joback Calculated Property
Cp,gas	1385.18	J/mol×K	942.02	Joback Calculated Property
Cp,gas	1405.86	J/mol×K	975.25	Joback Calculated Property
Cp,gas	1425.20	J/mol×K	1008.47	Joback Calculated Property
Cp,gas	1443.24	J/mol×K	1041.69	Joback Calculated Property
Cp,gas	1460.05	J/mol×K	1074.91	Joback Calculated Property
η	[0.0000234; 0.0009744]	Pa×s	[436.38; 875.58]
η	0.0009744	Pa×s	436.38	Joback Calculated Property
η	0.0003351	Pa×s	509.58	Joback Calculated Property
η	0.0001507	Pa×s	582.78	Joback Calculated Property
η	0.0000810	Pa×s	655.98	Joback Calculated Property
η	0.0000493	Pa×s	729.18	Joback Calculated Property
η	0.0000329	Pa×s	802.38	Joback Calculated Property
η	0.0000234	Pa×s	875.58	Joback Calculated Property

Similar Compounds

Find more compounds similar to Tetracosanoic acid, propyl ester.

Sources

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

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