Chemical Properties of Benzo[b]benzo[3,4]cyclobuta[1,2-e][1,4]dioxin, 4b,10a-dihydro-4b-phenyl-

InChI

InChI=1S/C20H14O2/c1-2-8-14(9-3-1)20-16-11-5-4-10-15(16)19(20)21-17-12-6-7-13-18(17)22-20/h1-13,19H

InChI Key

PSQTZUPHZFJNTH-UHFFFAOYSA-N

Formula

C20H14O2

SMILES

c1ccc(C23Oc4ccccc4OC2c2ccccc23)cc1

Molecular Weight¹

286.33

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[618.63; 728.17]	J/mol×K	[806.28; 1082.59]
Cp,gas	618.63	J/mol×K	806.28	Joback Calculated Property
Cp,gas	635.71	J/mol×K	852.33	Joback Calculated Property
Cp,gas	652.64	J/mol×K	898.38	Joback Calculated Property
Cp,gas	669.89	J/mol×K	944.44	Joback Calculated Property
Cp,gas	687.92	J/mol×K	990.49	Joback Calculated Property
Cp,gas	707.19	J/mol×K	1036.54	Joback Calculated Property
Cp,gas	728.17	J/mol×K	1082.59	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzo[b]benzo[3,4]cyclobuta[1,2-e][1,4]dioxin, 4b,10a-dihydro-4b-phenyl-.

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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