4-O-Benzoyl Pyridoxine
[CAS# 5223-10-9]

Identification

• Name: 4-O-Benzoyl Pyridoxine
• Synonyms: [3-Hydroxy-5-(Hydroxymethyl)-2-Methyl-4-Pyridyl]Methyl Benzoate; Benzoic Acid [3-Hydroxy-5-(Hydroxymethyl)-2-Methyl-4-Pyridyl]Methyl Ester; Benzoic Acid (3-Hydroxy-2-Methyl-5-Methylol-4-Pyridyl)Methyl Ester
• Molecular Formula: C₁₅H₁₅NO₄
• Molecular Weight: 273.29
• CAS Registry Number: 5223-10-9
• SMILES: C1=NC(=C(C(=C1CO)COC(=O)C2=CC=CC=C2)O)C
• InChI: 1S/C15H15NO4/c1-10-14(18)13(12(8-17)7-16-10)9-20-15(19)11-5-3-2-4-6-11/h2-7,17-18H,8-9H2,1H3
• InChIKey: VYPDKSKLULNJPO-UHFFFAOYSA-N

Properties

• Density: 1.303g/cm³ (Cal.)
• Boiling point: 536.117°C at 760 mmHg (Cal.)
• Flash point: 278.034°C (Cal.)