Chemical Properties of 3-Hexene, 3-methoxy-2-methyl-, (Z)-

InChI

InChI=1S/C8H16O/c1-5-6-8(9-4)7(2)3/h6-7H,5H2,1-4H3/b8-6-

InChI Key

KLLLUNXXSVCGMP-VURMDHGXSA-N

Formula

C8H16O

SMILES

CC/C=C(\OC)C(C)C

Molecular Weight¹

128.21

• 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).
• 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[176.43; 420.24]	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			5.56100e+00
Coefficient B			7.26480e-01
Coefficient C			-3.89700e-04
Coefficient D			7.79000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	176.43	J/mol×K	273.00	Calculated Property
Cp,gas	217.25	J/mol×K	353.78	Calculated Property
Cp,gas	254.06	J/mol×K	434.56	Calculated Property
Cp,gas	287.11	J/mol×K	515.33	Calculated Property
Cp,gas	316.65	J/mol×K	596.11	Calculated Property
Cp,gas	342.91	J/mol×K	676.89	Calculated Property
Cp,gas	366.16	J/mol×K	757.67	Calculated Property
Cp,gas	386.63	J/mol×K	838.44	Calculated Property
Cp,gas	404.58	J/mol×K	919.22	Calculated Property
Cp,gas	420.24	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to 3-Hexene, 3-methoxy-2-methyl-, (Z)-.

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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