Chemical Properties of Pentaerythritol tetraacetate (CAS 597-71-7)

InChI

InChI=1S/C13H20O8/c1-9(14)18-5-13(6-19-10(2)15,7-20-11(3)16)8-21-12(4)17/h5-8H2,1-4H3

InChI Key

OUHCZCFQVONTOC-UHFFFAOYSA-N

Formula

C13H20O8

SMILES

CC(=O)OCC(COC(C)=O)(COC(C)=O)COC(C)=O

Molecular Weight¹

304.29

CAS

597-71-7

Other Names

• 1,3-Propanediol, 2,2-bis[(acetyloxy)methyl]-, 1,3-diacetate
• 1,3-Propanediol, 2,2-bis[(acetyloxy)methyl]-, diacetate
• 2,2-Bis((acetyloxy)methyl)-1,3-propanediol diacetate
• NSC 1841
• Normo-level
• Normosterol
• PAG
• Pentaerythritole tetraacetate
• Pentaerythrityl tetraacetate
• Pentaerythrityl tetracetate
• T. A. P. E.
• TAPE
• Tetraacetil pentoetriol
• Tetraacetyl pentestriol
• [3-acetyloxy-2,2-bis(acetyloxymethyl)propyl] acetate

• 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).
• 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

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[661.71; 720.90]	J/mol×K	[798.77; 996.87]
Cp,gas	661.71	J/mol×K	798.77	Joback Calculated Property
Cp,gas	673.98	J/mol×K	831.79	Joback Calculated Property
Cp,gas	685.30	J/mol×K	864.80	Joback Calculated Property
Cp,gas	695.66	J/mol×K	897.82	Joback Calculated Property
Cp,gas	705.05	J/mol×K	930.83	Joback Calculated Property
Cp,gas	713.47	J/mol×K	963.85	Joback Calculated Property
Cp,gas	720.90	J/mol×K	996.87	Joback Calculated Property
η	[0.0000597; 0.0004840]	Pa×s	[527.33; 798.77]
η	0.0004840	Pa×s	527.33	Joback Calculated Property
η	0.0002975	Pa×s	572.57	Joback Calculated Property
η	0.0001964	Pa×s	617.81	Joback Calculated Property
η	0.0001372	Pa×s	663.05	Joback Calculated Property
η	0.0001003	Pa×s	708.29	Joback Calculated Property
η	0.0000762	Pa×s	753.53	Joback Calculated Property
η	0.0000597	Pa×s	798.77	Joback Calculated Property

Similar Compounds

Find more compounds similar to Pentaerythritol tetraacetate.

Sources

• Crippen Method
• Joback Method
• Aqueous Solubility Prediction Method
• McGowan Method
• NIST Webbook

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