Chemical Properties of Glyceryl tri-18-acetoxystearate

InChI

InChI=1S/C63H116O12/c1-57(64)70-52-46-40-34-28-22-16-10-4-7-13-19-25-31-37-43-49-61(67)73-55-60(75-63(69)51-45-39-33-27-21-15-9-6-12-18-24-30-36-42-48-54-72-59(3)66)56-74-62(68)50-44-38-32-26-20-14-8-5-11-17-23-29-35-41-47-53-71-58(2)65/h60H,4-56H2,1-3H3

InChI Key

GKLLDHHZSUEWRE-UHFFFAOYSA-N

Formula

C63H116O12

SMILES

CC(=O)OCCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCCOC(C)=O)OC(=O)CCCCCCCCCCCCCCCCCOC(C)=O

Molecular Weight¹

1065.61

• 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[3244.99; 8433900.84]	J/mol×K	[1989.92; 30157.61]
Cp,gas	3244.99	J/mol×K	1989.92	Joback Calculated Property
Cp,gas	29215.76	J/mol×K	6684.54	Joback Calculated Property
Cp,gas	279556.42	J/mol×K	11379.15	Joback Calculated Property
Cp,gas	999731.13	J/mol×K	16073.77	Joback Calculated Property
Cp,gas	2435204.01	J/mol×K	20768.38	Joback Calculated Property
Cp,gas	4831439.20	J/mol×K	25463.00	Joback Calculated Property
Cp,gas	8433900.84	J/mol×K	30157.61	Joback Calculated Property
η	[1.6665017e-09; 8.7945138e-08]	Pa×s	[1038.75; 1989.92]
η	8.7945138e-08	Pa×s	1038.75	Joback Calculated Property
η	2.9315341e-08	Pa×s	1197.28	Joback Calculated Property
η	1.2634332e-08	Pa×s	1355.81	Joback Calculated Property
η	6.4944650e-09	Pa×s	1514.34	Joback Calculated Property
η	3.7871293e-09	Pa×s	1672.86	Joback Calculated Property
η	2.4245332e-09	Pa×s	1831.39	Joback Calculated Property
η	1.6665017e-09	Pa×s	1989.92	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glyceryl tri-18-acetoxystearate.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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