5-Hexyl-6-Methyl-1H-Pyrimidin-4-One
[CAS# 103980-65-0]

Identification

• Name: 5-Hexyl-6-Methyl-1H-Pyrimidin-4-One
• Synonyms: 4-Pyrimidinol, 5-Hexyl-5-Methyl-; 5-Hexyl-6-Methyl-4-Pyrimidinol
• Molecular Formula: C₁₁H₁₈N₂O
• Molecular Weight: 194.28
• CAS Registry Number: 103980-65-0
• SMILES: C(CCC1=C(NC=NC1=O)C)CCC
• InChI: 1S/C11H18N2O/c1-3-4-5-6-7-10-9(2)12-8-13-11(10)14/h8H,3-7H2,1-2H3,(H,12,13,14)
• InChIKey: MCTGQFTYMMFWLE-UHFFFAOYSA-N

Properties

• Density: 1.044g/cm³ (Cal.)
• Boiling point: 291.092°C at 760 mmHg (Cal.)
• Flash point: 129.848°C (Cal.)