1-Hydroxy-6-(1-Hydroxy-1-Methylpropyl)-3-(2-Methylpropyl)-2(1H)-Pyrazinone
[CAS# 4562-39-4]

Identification

• Name: 1-Hydroxy-6-(1-Hydroxy-1-Methylpropyl)-3-(2-Methylpropyl)-2(1H)-Pyrazinone
• Synonyms: 1-Hydroxy-6-(1-Hydroxy-1-Methyl-Propyl)-3-Isobutyl-Pyrazin-2-One; 1-Hydroxy-6-(1-Hydroxy-1-Methylpropyl)-3-Isobutyl-2-Pyrazinone; Brn 0655115
• Molecular Formula: C₁₂H₂₀N₂O₃
• Molecular Weight: 240.30
• CAS Registry Number: 4562-39-4
• SMILES: C(C1=NC=C(N(C1=O)O)C(O)(CC)C)C(C)C
• InChI: 1S/C12H20N2O3/c1-5-12(4,16)10-7-13-9(6-8(2)3)11(15)14(10)17/h7-8,16-17H,5-6H2,1-4H3
• InChIKey: ARNQMQXMJRUMRP-UHFFFAOYSA-N

Properties

• Density: 1.163g/cm³ (Cal.)
• Boiling point: 389.667°C at 760 mmHg (Cal.)
• Flash point: 189.464°C (Cal.)