Chemical Properties of Benz[5,6]indeno[2,1-a]phenalene (CAS 76727-41-8)

InChI

InChI=1S/C24H14/c1-2-6-17-12-21-19(11-16(17)5-1)14-22-20-10-4-8-15-7-3-9-18(24(15)20)13-23(21)22/h1-14H

InChI Key

KXAYQKOGXBEXSV-UHFFFAOYSA-N

Formula

C24H14

SMILES

C1=c2c(cc3cccc4cccc2c43)-c2cc3ccccc3cc21

Molecular Weight¹

302.37

CAS

76727-41-8

• ω : Acentric Factor.
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation 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

Similar Compounds

Find more compounds similar to Benz[5,6]indeno[2,1-a]phenalene.

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
• McGowan Method
• NIST Webbook

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