Chemical Properties of 2-Pyridinecarboxylic acid, 5-butyl- (CAS 536-69-6)

InChI

InChI=1S/C10H13NO2/c1-2-3-4-8-5-6-9(10(12)13)11-7-8/h5-7H,2-4H2,1H3,(H,12,13)

InChI Key

DGMPVYSXXIOGJY-UHFFFAOYSA-N

Formula

C10H13NO2

SMILES

CCCCc1ccc(C(=O)O)nc1

Molecular Weight¹

179.22

CAS

536-69-6

Other Names

• Picolinic acid, 5-butyl-
• Fusaric acid
• 5-n-Butylpyridine-2-carboxylic acid
• 5-Butylpicolinic acid
• 5-Butyl-2-pyridinecarboxylic acid
• Fusarinic acid
• 5-butylpyridine-3-carboxylic acid

• 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 2-Pyridinecarboxylic acid, 5-butyl-.

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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