Chemical Properties of 2,2-Diisopropyl-1,3-dioxolane (CAS 4421-10-7)

InChI

InChI=1S/C9H18O2/c1-7(2)9(8(3)4)10-5-6-11-9/h7-8H,5-6H2,1-4H3

InChI Key

BIYJJEWTEPSHGZ-UHFFFAOYSA-N

Formula

C9H18O2

SMILES

CC(C)C1(C(C)C)OCCO1

Molecular Weight¹

158.24

CAS

4421-10-7

Other Names

• 1,3-Dioxolane, 2,2-bis(1-methylethyl)-

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• Δ_vapH : Enthalpy of vaporization at a given temperature (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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, 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.

Temperature Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[193.34; 514.39]	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			-8.44900e+01
Coefficient B			1.28828e+00
Coefficient C			-1.10440e-03
Coefficient D			4.15000e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	193.34	J/mol×K	273.00	Calculated Property
Cp,gas	251.43	J/mol×K	353.78	Calculated Property
Cp,gas	300.84	J/mol×K	434.56	Calculated Property
Cp,gas	342.91	J/mol×K	515.33	Calculated Property
Cp,gas	378.93	J/mol×K	596.11	Calculated Property
Cp,gas	410.23	J/mol×K	676.89	Calculated Property
Cp,gas	438.11	J/mol×K	757.67	Calculated Property
Cp,gas	463.89	J/mol×K	838.44	Calculated Property
Cp,gas	488.88	J/mol×K	919.22	Calculated Property
Cp,gas	514.39	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to 2,2-Diisopropyl-1,3-dioxolane.

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

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.
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