4-[5-Hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]butanoic acid
[CAS# 801999-41-7]

Identification

• Name: 4-[5-Hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]butanoic acid
• Synonyms: 3-PYRIDINEBUTANOICACID, 5-HYDROXY-4-(HYDROXYMETHYL)-6-METHYL-; 4-(5-hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl)butanoic acid
• Molecular Formula: C₁₁H₁₅NO₄
• Molecular Weight: 225.24
• CAS Registry Number: 801999-41-7
• SMILES: Cc1c(c(c(cn1)CCCC(=O)O)CO)O
• InChI: 1S/C11H15NO4/c1-7-11(16)9(6-13)8(5-12-7)3-2-4-10(14)15/h5,13,16H,2-4,6H2,1H3,(H,14,15)
• InChIKey: NFIPKJIQMCJRJN-UHFFFAOYSA-N

Properties

• Density: 1.312g/cm³ (Cal.)
• Boiling point: 533.323°C at 760 mmHg (Cal.)
• Flash point: 276.344°C (Cal.)
• Refractive index: 1.589 (Cal.)