Chemical Properties of Bicyclo[3.2.0]hept-2-ene, 4-ethoxy-, endo-

InChI

InChI=1S/C9H14O/c1-2-10-9-6-4-7-3-5-8(7)9/h4,6-9H,2-3,5H2,1H3

InChI Key

VIFJCKJDUKYPNS-UHFFFAOYSA-N

Formula

C9H14O

SMILES

CCOC1C=CC2CCC21

Molecular Weight¹

138.21

• 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).
• I_np : Non-polar retention indices.
• 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	[155.82; 438.76]	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			-7.16790e+01
Coefficient B			1.00532e+00
Coefficient C			-6.80680e-04
Coefficient D			1.85800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	155.82	J/mol×K	273.00	Calculated Property
Cp,gas	207.01	J/mol×K	353.78	Calculated Property
Cp,gas	251.90	J/mol×K	434.56	Calculated Property
Cp,gas	291.06	J/mol×K	515.33	Calculated Property
Cp,gas	325.08	J/mol×K	596.11	Calculated Property
Cp,gas	354.56	J/mol×K	676.89	Calculated Property
Cp,gas	380.08	J/mol×K	757.67	Calculated Property
Cp,gas	402.23	J/mol×K	838.44	Calculated Property
Cp,gas	421.59	J/mol×K	919.22	Calculated Property
Cp,gas	438.76	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0006514; 0.0005206]	Pa×s	[242.30; 448.23]	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			-7.82423e+00
Coefficient B			1.18210e+02
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.			242.30
Temperature range, max.			448.23
η	0.0006514	Pa×s	242.30	Calculated Property
η	0.0006246	Pa×s	265.18	Calculated Property
η	0.0006028	Pa×s	288.06	Calculated Property
η	0.0005849	Pa×s	310.94	Calculated Property
η	0.0005699	Pa×s	333.83	Calculated Property
η	0.0005571	Pa×s	356.71	Calculated Property
η	0.0005460	Pa×s	379.59	Calculated Property
η	0.0005365	Pa×s	402.47	Calculated Property
η	0.0005281	Pa×s	425.35	Calculated Property
η	0.0005206	Pa×s	448.23	Calculated Property

Similar Compounds

Find more compounds similar to Bicyclo[3.2.0]hept-2-ene, 4-ethoxy-, endo-.

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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