Chemical Properties of 7,8-DIOXABICYCLO(4,2,2)DEC-9-ENE

InChI

InChI=1S/C8H12O2/c1-2-4-8-6-5-7(3-1)9-10-8/h5-8H,1-4H2

InChI Key

MNEHGPASSFGNGC-UHFFFAOYSA-N

Formula

C8H12O2

SMILES

C1=CC2CCCCC1OO2

Molecular Weight¹

140.18

• 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).
• IE : Ionization energy (eV).
• 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, 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	[136.99; 406.39]	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			-8.29300e+01
Coefficient B			9.65200e-01
Coefficient C			-6.25680e-04
Coefficient D			1.49800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	136.99	J/mol×K	273.00	Calculated Property
Cp,gas	186.86	J/mol×K	353.78	Calculated Property
Cp,gas	230.64	J/mol×K	434.56	Calculated Property
Cp,gas	268.81	J/mol×K	515.33	Calculated Property
Cp,gas	301.83	J/mol×K	596.11	Calculated Property
Cp,gas	330.19	J/mol×K	676.89	Calculated Property
Cp,gas	354.35	J/mol×K	757.67	Calculated Property
Cp,gas	374.79	J/mol×K	838.44	Calculated Property
Cp,gas	391.97	J/mol×K	919.22	Calculated Property
Cp,gas	406.39	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0045419; 0.0004513]	Pa×s	[255.62; 486.55]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.02591e+01
Coefficient B			1.24350e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			255.62
Temperature range, max.			486.55
η	0.0045419	Pa×s	255.62	Calculated Property
η	0.0029141	Pa×s	281.28	Calculated Property
η	0.0020138	Pa×s	306.94	Calculated Property
η	0.0014732	Pa×s	332.60	Calculated Property
η	0.0011271	Pa×s	358.26	Calculated Property
η	0.0008938	Pa×s	383.92	Calculated Property
η	0.0007296	Pa×s	409.57	Calculated Property
η	0.0006100	Pa×s	435.23	Calculated Property
η	0.0005203	Pa×s	460.89	Calculated Property
η	0.0004513	Pa×s	486.55	Calculated Property

Similar Compounds

Find more compounds similar to 7,8-DIOXABICYCLO(4,2,2)DEC-9-ENE.

Sources

• 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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