3-Butanoyl-1-Methyl-5-[3-(Trifluoromethyl)Phenyl]Pyridin-4-One
[CAS# 82129-69-9]

Identification

• Name: 3-Butanoyl-1-Methyl-5-[3-(Trifluoromethyl)Phenyl]Pyridin-4-One
• Synonyms: 1-Methyl-3-(1-Oxobutyl)-5-[3-(Trifluoromethyl)Phenyl]-4-Pyridinone; 3-Butyryl-1-Methyl-5-[3-(Trifluoromethyl)Phenyl]-4-Pyridone; 1-Methyl-3-(1-Oxobutyl)-5-(3-(Trifluoromethyl)Phenyl)-4(1H)-Pyridinone
• Molecular Formula: C₁₇H₁₆F₃NO₂
• Molecular Weight: 323.31
• CAS Registry Number: 82129-69-9
• SMILES: C1=C(C=CC=C1C2=CN(C=C(C2=O)C(CCC)=O)C)C(F)(F)F
• InChI: 1S/C17H16F3NO2/c1-3-5-15(22)14-10-21(2)9-13(16(14)23)11-6-4-7-12(8-11)17(18,19)20/h4,6-10H,3,5H2,1-2H3
• InChIKey: LBVMSONAOSABQL-UHFFFAOYSA-N

Properties

• Density: 1.251g/cm³ (Cal.)
• Boiling point: 429.931°C at 760 mmHg (Cal.)
• Flash point: 213.815°C (Cal.)