Chemical Properties of 2-Methoxy-3-methyl-4-oxo-1-pentene (CAS 82481-17-2)

InChI

InChI=1S/C7H12O2/c1-5(6(2)8)7(3)9-4/h5H,3H2,1-2,4H3

InChI Key

QQCBOBNMUPQOEQ-UHFFFAOYSA-N

Formula

C7H12O2

SMILES

C=C(OC)C(C)C(C)=O

Molecular Weight¹

128.17

CAS

82481-17-2

• 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_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).
• T_boil : Normal Boiling Point Temperature (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 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	[222.95; 282.49]	J/mol×K	[432.17; 619.96]
Cp,gas	222.95	J/mol×K	432.17	Joback Calculated Property
Cp,gas	233.92	J/mol×K	463.47	Joback Calculated Property
Cp,gas	244.47	J/mol×K	494.77	Joback Calculated Property
Cp,gas	254.60	J/mol×K	526.07	Joback Calculated Property
Cp,gas	264.31	J/mol×K	557.37	Joback Calculated Property
Cp,gas	273.60	J/mol×K	588.66	Joback Calculated Property
Cp,gas	282.49	J/mol×K	619.96	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-Methoxy-3-methyl-4-oxo-1-pentene.

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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