Chemical Properties of Cyclopropanetetradecanoic acid, 2-octyl-, methyl ester

InChI

InChI=1S/C26H50O2/c1-3-4-5-6-14-17-20-24-23-25(24)21-18-15-12-10-8-7-9-11-13-16-19-22-26(27)28-2/h24-25H,3-23H2,1-2H3

InChI Key

JBDGXWZXMAXBLS-UHFFFAOYSA-N

Formula

C26H50O2

SMILES

CCCCCCCCC1CC1CCCCCCCCCCCCCC(=O)OC

Molecular Weight¹

394.68

• 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	[552.20; 1355.20]	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			-3.96400e+01
Coefficient B			2.54344e+00
Coefficient C			-1.46080e-03
Coefficient D			3.12200e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	552.20	J/mol×K	273.00	Calculated Property
Cp,gas	691.16	J/mol×K	353.78	Calculated Property
Cp,gas	815.39	J/mol×K	434.56	Calculated Property
Cp,gas	925.86	J/mol×K	515.33	Calculated Property
Cp,gas	1023.57	J/mol×K	596.11	Calculated Property
Cp,gas	1109.50	J/mol×K	676.89	Calculated Property
Cp,gas	1184.64	J/mol×K	757.67	Calculated Property
Cp,gas	1249.98	J/mol×K	838.44	Calculated Property
Cp,gas	1306.51	J/mol×K	919.22	Calculated Property
Cp,gas	1355.20	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0015504; 0.0001754]	Pa×s	[438.81; 732.57]	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			-1.19039e+01
Coefficient B			2.38479e+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.			438.81
Temperature range, max.			732.57
η	0.0015504	Pa×s	438.81	Calculated Property
η	0.0010642	Pa×s	471.45	Calculated Property
η	0.0007670	Pa×s	504.09	Calculated Property
η	0.0005752	Pa×s	536.73	Calculated Property
η	0.0004459	Pa×s	569.37	Calculated Property
η	0.0003553	Pa×s	602.01	Calculated Property
η	0.0002898	Pa×s	634.65	Calculated Property
η	0.0002412	Pa×s	667.29	Calculated Property
η	0.0002041	Pa×s	699.93	Calculated Property
η	0.0001754	Pa×s	732.57	Calculated Property

Similar Compounds

Find more compounds similar to Cyclopropanetetradecanoic acid, 2-octyl-, methyl ester.

Sources

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

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