Chemical Properties of 1H-Benz[fg]aceanthrylene

InChI

InChI=1S/C19H12/c1-2-6-15-14(5-1)16-7-3-4-12-8-9-13-10-11-17(15)19(13)18(12)16/h1-10H,11H2

InChI Key

CBTNLQKGXWTRFH-UHFFFAOYSA-N

Formula

C19H12

SMILES

C1=c2ccc3cccc4c5ccccc5c(c2c34)C1

Molecular Weight¹

240.31

• 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).
• T_boil : Normal Boiling Point 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 Temperature, 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.

Similar Compounds

Find more compounds similar to 1H-Benz[fg]aceanthrylene.

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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