Chemical Properties of Dibenzo[a,e]cyclooctene

InChI

InChI=1S/C16H12/c1-2-6-14-11-12-16-8-4-3-7-15(16)10-9-13(14)5-1/h1-12H/b10-9+,12-11?,13-9-,14-11-,15-10+,16-12?

InChI Key

VGQWCQNHAMVTJY-YFDRDTFESA-N

Formula

C16H12

SMILES

C1=C\c2ccccc2/C=C\c2ccccc2/1

Molecular Weight¹

204.27

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[191.94; 513.91]	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			-9.66100e+01
Coefficient B			1.30280e+00
Coefficient C			-9.78680e-04
Coefficient D			2.86400e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	191.94	J/mol×K	273.00	Calculated Property
Cp,gas	254.48	J/mol×K	353.78	Calculated Property
Cp,gas	308.22	J/mol×K	434.56	Calculated Property
Cp,gas	354.06	J/mol×K	515.33	Calculated Property
Cp,gas	392.90	J/mol×K	596.11	Calculated Property
Cp,gas	425.65	J/mol×K	676.89	Calculated Property
Cp,gas	453.23	J/mol×K	757.67	Calculated Property
Cp,gas	476.52	J/mol×K	838.44	Calculated Property
Cp,gas	496.45	J/mol×K	919.22	Calculated Property
Cp,gas	513.91	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0015202; 0.0002646]	Pa×s	[368.14; 633.99]	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			-1.06585e+01
Coefficient B			1.53502e+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.			368.14
Temperature range, max.			633.99
η	0.0015202	Pa×s	368.14	Calculated Property
η	0.0011153	Pa×s	397.68	Calculated Property
η	0.0008541	Pa×s	427.22	Calculated Property
η	0.0006770	Pa×s	456.76	Calculated Property
η	0.0005520	Pa×s	486.30	Calculated Property
η	0.0004607	Pa×s	515.84	Calculated Property
η	0.0003921	Pa×s	545.38	Calculated Property
η	0.0003393	Pa×s	574.92	Calculated Property
η	0.0002978	Pa×s	604.46	Calculated Property
η	0.0002646	Pa×s	633.99	Calculated Property

Similar Compounds

Find more compounds similar to Dibenzo[a,e]cyclooctene.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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