Chemical Properties of Naphtho[1,2-d]thiazole, 2-methyl- (CAS 2682-45-3)

InChI

InChI=1S/C12H9NS/c1-8-13-12-10-5-3-2-4-9(10)6-7-11(12)14-8/h2-7H,1H3

InChI Key

OUXMJRMYZCEVKO-UHFFFAOYSA-N

Formula

C12H9NS

SMILES

Cc1nc2c(ccc3ccccc32)s1

Molecular Weight¹

199.27

CAS

2682-45-3

Other Names

• 2-Methyl-«beta»-naphthothiazole
• 2-methyl-.beta.-naphthothiazole
• 2-methylnaphtho[1,2-d]thiazole
• Naphth[1,2-d]thiazole, 2-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).
• 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 Naphtho[1,2-d]thiazole, 2-methyl-.

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
• Thermodynamic properties of naphthoxazole and naphthothiazole derivatives: Experimental and computational studies
• McGowan Method
• NIST Webbook

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