Chemical Properties of Stearic acid, triethylcitrate ester

InChI

InChI=1S/C30H54O8/c1-5-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26(31)38-30(29(34)37-8-4,24-27(32)35-6-2)25-28(33)36-7-3/h5-25H2,1-4H3

InChI Key

CPWUFKKGVRVSNX-UHFFFAOYSA-N

Formula

C30H54O8

SMILES

CCCCCCCCCCCCCCCCCC(=O)OC(CC(=O)OCC)(CC(=O)OCC)C(=O)OCC

Molecular Weight¹

542.75

• 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).
• 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, Ionization energy 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	[705.78; 1600.96]	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			5.27810e+01
Coefficient B			2.76048e+00
Coefficient C			-1.40160e-03
Coefficient D			1.89300e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	705.78	J/mol×K	273.00	Calculated Property
Cp,gas	862.34	J/mol×K	353.78	Calculated Property
Cp,gas	1003.22	J/mol×K	434.56	Calculated Property
Cp,gas	1129.03	J/mol×K	515.33	Calculated Property
Cp,gas	1240.38	J/mol×K	596.11	Calculated Property
Cp,gas	1337.84	J/mol×K	676.89	Calculated Property
Cp,gas	1422.04	J/mol×K	757.67	Calculated Property
Cp,gas	1493.56	J/mol×K	838.44	Calculated Property
Cp,gas	1553.00	J/mol×K	919.22	Calculated Property
Cp,gas	1600.96	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0000926; 0.0000036]	Pa×s	[599.60; 991.13]	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			-1.75173e+01
Coefficient B			4.93466e+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.			599.60
Temperature range, max.			991.13
η	0.0000926	Pa×s	599.60	Calculated Property
η	0.0000531	Pa×s	643.10	Calculated Property
η	0.0000326	Pa×s	686.61	Calculated Property
η	0.0000213	Pa×s	730.11	Calculated Property
η	0.0000145	Pa×s	773.62	Calculated Property
η	0.0000104	Pa×s	817.12	Calculated Property
η	0.0000076	Pa×s	860.62	Calculated Property
η	0.0000058	Pa×s	904.13	Calculated Property
η	0.0000045	Pa×s	947.63	Calculated Property
η	0.0000036	Pa×s	991.13	Calculated Property

Similar Compounds

Find more compounds similar to Stearic acid, triethylcitrate ester.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
These property values are available through the Cheméo API. A free account gives you an access key.