Chemical Properties of 3-Pyridinol, 6-methyl-, acetate (ester) (CAS 4842-89-1)

InChI

InChI=1S/C8H9NO2/c1-6-3-4-8(5-9-6)11-7(2)10/h3-5H,1-2H3

InChI Key

WXLRJJLUBRXUPX-UHFFFAOYSA-N

Formula

C8H9NO2

SMILES

CC(=O)Oc1ccc(C)nc1

Molecular Weight¹

151.16

CAS

4842-89-1

Other Names

• 2-Methyl-5-acetoxypyridine
• 5-Acetoxy-2-methylpyridine
• 5-Acetoxy-2-picoline

• 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 3-Pyridinol, 6-methyl-, acetate (ester).

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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