4-Hydroxy-1-(3-Pyridinyl)-1-(4,4-²H₂)Butanone
[CAS# 154603-21-1]

Identification

• Name: 4-Hydroxy-1-(3-Pyridinyl)-1-(4,4-²H₂)Butanone
• Synonyms: 4-Hydroxy-1-(3-pyridyl)-1-butanone-4,4-d2
• Molecular Formula: C₉H₉D₂NO₂
• Molecular Weight: 167.20
• CAS Registry Number: 154603-21-1
• SMILES: [2H]C([2H])(CCC(=O)c1cccnc1)O
• InChI: 1S/C9H11NO2/c11-6-2-4-9(12)8-3-1-5-10-7-8/h1,3,5,7,11H,2,4,6H2/i6D2
• InChIKey: KTXUGZHJVRHQGP-NCYHJHSESA-N

Properties

• Density: 1.155g/cm³ (Cal.)
• Boiling point: 345.649°C at 760 mmHg (Cal.)
• Flash point: 162.843°C (Cal.)
• Refractive index: 1.537 (Cal.)