Chemical Properties of .alpha.-Acetyl-.alpha.-methyl-gammabutyrolactone

InChI

InChI=1S/C7H10O3/c1-5(8)7(2)3-4-10-6(7)9/h3-4H2,1-2H3

InChI Key

VKDGCPFTXXDWQJ-UHFFFAOYSA-N

Formula

C7H10O3

SMILES

CC(=O)C1(C)CCOC1=O

Molecular Weight¹

142.15

Other Names

• «alpha»-Acetyl-«alpha»-methyl-gammabutyrolactone
• «alpha»-acetyl-«alpha»-methyl-«gamma»-butyrolactone

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boilr : Boiling point at reduced pressure (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, 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

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[251.89; 320.03]	J/mol×K	[523.72; 757.30]
Cp,gas	251.89	J/mol×K	523.72	Joback Calculated Property
Cp,gas	264.96	J/mol×K	562.65	Joback Calculated Property
Cp,gas	277.22	J/mol×K	601.58	Joback Calculated Property
Cp,gas	288.75	J/mol×K	640.51	Joback Calculated Property
Cp,gas	299.66	J/mol×K	679.44	Joback Calculated Property
Cp,gas	310.06	J/mol×K	718.37	Joback Calculated Property
Cp,gas	320.03	J/mol×K	757.30	Joback Calculated Property

Pressure Dependent Properties

Similar Compounds

Find more compounds similar to .alpha.-Acetyl-.alpha.-methyl-gammabutyrolactone.

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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