Chemical Properties of 2,4,8,10-Tetraoxaspiro[5.5]undecane

InChI

InChI=1S/C7H12O4/c1-7(2-9-5-8-1)3-10-6-11-4-7/h1-6H2

InChI Key

BGCSUUSPRCDKBQ-UHFFFAOYSA-N

Formula

C7H12O4

SMILES

C1OCC2(CO1)COCOC2

Molecular Weight¹

160.17

Other Names

• 5,5'-Spirobi-1,3-dioxane
• 5,5'-Spirobi-m-dioxane
• Formaldehyde, cyclic diacetal with pentaerythritol
• NSC 139455
• Pentaerythritol bisformal
• Pentaerythritol cyclic diformal
• Pentaerythritol diformal
• Pentaerythritol, bis(cyclic acetal) with formaldehyde-
• Pentaerythritol, dimethylene-

• Δ_cH°_solid : Standard solid enthalpy of combustion (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_subH° : Enthalpy of sublimation at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boil : Normal Boiling Point Temperature (K).
• T_boilr : Boiling point at reduced pressure (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l 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.

Pressure Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[145.88; 427.59]	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			-1.16210e+02
Coefficient B			1.22900e+00
Coefficient C			-1.09780e-03
Coefficient D			4.12600e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	145.88	J/mol×K	273.00	Calculated Property
Cp,gas	199.45	J/mol×K	353.78	Calculated Property
Cp,gas	244.41	J/mol×K	434.56	Calculated Property
Cp,gas	282.06	J/mol×K	515.33	Calculated Property
Cp,gas	313.71	J/mol×K	596.11	Calculated Property
Cp,gas	340.66	J/mol×K	676.89	Calculated Property
Cp,gas	364.22	J/mol×K	757.67	Calculated Property
Cp,gas	385.69	J/mol×K	838.44	Calculated Property
Cp,gas	406.38	J/mol×K	919.22	Calculated Property
Cp,gas	427.59	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to 2,4,8,10-Tetraoxaspiro[5.5]undecane.

Sources

• Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) ChEDL chemicals 1.5.2, from Bradley, J.-C.; Williams, A.; Lang, A. Jean-Claude Bradley Open Melting Point Dataset. Figshare, 2014 (CC0).
• 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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Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
Compiled This icon marks a compiled value or equation: taken from a data compilation such as ChemSep, not from an original measurement report.
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