4-(Methylnitrosamino)-1-(3-Pyridyl-N-Oxide)-1-Butanone
[CAS# 76014-82-9]

Identification

• Name: 4-(Methylnitrosamino)-1-(3-Pyridyl-N-Oxide)-1-Butanone
• Synonyms: N-Methyl-N-[4-(1-Oxidopyridin-1-Ium-3-Yl)-4-Oxo-Butyl]Nitrous Amide; N-Methyl-N-[4-(1-Oxido-3-Pyridin-1-Iumyl)-4-Oxobutyl]Nitrous Amide; N-[4-Keto-4-(1-Oxidopyridin-1-Ium-3-Yl)Butyl]-N-Methyl-Nitrous Amide
• Molecular Formula: C₁₀H₁₃N₃O₃
• Molecular Weight: 223.23
• CAS Registry Number: 76014-82-9
• SMILES: C1=C(C(CCCN(N=O)C)=O)C=CC=[N+]1[O-]
• InChI: 1S/C10H13N3O3/c1-12(11-15)6-3-5-10(14)9-4-2-7-13(16)8-9/h2,4,7-8H,3,5-6H2,1H3
• InChIKey: KRRWRVSPMYAJPF-UHFFFAOYSA-N

Properties

• Density: 1.224g/cm³ (Cal.)
• Boiling point: 532.462°C at 760 mmHg (Cal.)
• Flash point: 275.823°C (Cal.)