Chemical Properties of 3-Methoxy-1-methyl-1,3-cyclohexadiene (CAS 98677-97-5)

InChI

InChI=1S/C8H12O/c1-7-4-3-5-8(6-7)9-2/h5-6H,3-4H2,1-2H3

InChI Key

IGWOPMYDPJKFJT-UHFFFAOYSA-N

Formula

C8H12O

SMILES

COC1=CCCC(C)=C1

Molecular Weight¹

124.18

CAS

98677-97-5

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• 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	[213.23; 284.02]	J/mol×K	[437.36; 645.03]
Cp,gas	213.23	J/mol×K	437.36	Joback Calculated Property
Cp,gas	226.45	J/mol×K	471.97	Joback Calculated Property
Cp,gas	239.09	J/mol×K	506.58	Joback Calculated Property
Cp,gas	251.16	J/mol×K	541.19	Joback Calculated Property
Cp,gas	262.67	J/mol×K	575.80	Joback Calculated Property
Cp,gas	273.62	J/mol×K	610.42	Joback Calculated Property
Cp,gas	284.02	J/mol×K	645.03	Joback Calculated Property
η	[0.0002054; 0.0021942]	Pa×s	[240.33; 437.36]
η	0.0021942	Pa×s	240.33	Joback Calculated Property
η	0.0011661	Pa×s	273.17	Joback Calculated Property
η	0.0007098	Pa×s	306.01	Joback Calculated Property
η	0.0004757	Pa×s	338.85	Joback Calculated Property
η	0.0003422	Pa×s	371.68	Joback Calculated Property
η	0.0002596	Pa×s	404.52	Joback Calculated Property
η	0.0002054	Pa×s	437.36	Joback Calculated Property

Similar Compounds

Find more compounds similar to 3-Methoxy-1-methyl-1,3-cyclohexadiene.

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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