Chemical Properties of 4H-Dibenzo[a,de]pentacene

InChI

InChI=1S/C29H18/c1-2-7-19-13-23-16-27-24(15-22(23)12-18(19)6-1)17-28-25-10-4-3-8-20(25)14-21-9-5-11-26(27)29(21)28/h1-13,15-17H,14H2

InChI Key

BZZXPEWKRBRGLZ-UHFFFAOYSA-N

Formula

C29H18

SMILES

c1ccc2c(c1)Cc1cccc3c1c-2cc1cc2cc4ccccc4cc2cc13

Molecular Weight¹

366.46

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor 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	[876.93; 1020.16]	J/mol×K	[1025.15; 1300.94]
Cp,gas	876.93	J/mol×K	1025.15	Joback Calculated Property
Cp,gas	896.48	J/mol×K	1071.11	Joback Calculated Property
Cp,gas	917.18	J/mol×K	1117.08	Joback Calculated Property
Cp,gas	939.46	J/mol×K	1163.04	Joback Calculated Property
Cp,gas	963.76	J/mol×K	1209.01	Joback Calculated Property
Cp,gas	990.51	J/mol×K	1254.97	Joback Calculated Property
Cp,gas	1020.16	J/mol×K	1300.94	Joback Calculated Property
η	[0.0041224; 0.0061882]	Pa×s	[704.57; 1025.15]
η	0.0061882	Pa×s	704.57	Joback Calculated Property
η	0.0056468	Pa×s	758.00	Joback Calculated Property
η	0.0052152	Pa×s	811.43	Joback Calculated Property
η	0.0048642	Pa×s	864.86	Joback Calculated Property
η	0.0045737	Pa×s	918.29	Joback Calculated Property
η	0.0043298	Pa×s	971.72	Joback Calculated Property
η	0.0041224	Pa×s	1025.15	Joback Calculated Property

Similar Compounds

Find more compounds similar to 4H-Dibenzo[a,de]pentacene.

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
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