Chemical Properties of 1-Methylphenanthro[4,5-bcd]thiophene (CAS 88114-01-6)

InChI

InChI=1S/C15H10S/c1-9-5-8-13-15-11(9)7-6-10-3-2-4-12(16-13)14(10)15/h2-8H,1H3

InChI Key

OMUSOOJTHCVJNY-UHFFFAOYSA-N

Formula

C15H10S

SMILES

Cc1ccc2sc3cccc4ccc1c2c43

Molecular Weight¹

222.31

CAS

88114-01-6

Other Names

• Phenanthro[4,5-b]thiophene, 1-methyl

• 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).
• I_np : Non-polar retention indices.
• 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 1-Methylphenanthro[4,5-bcd]thiophene.

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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