1-(1-Oxidopyridin-6-yl)ethanone

Base Information

• Chemical Name: 1-(1-Oxidopyridin-6-yl)ethanone
• CAS No.: 2457-50-3
• Molecular Formula: C7H7NO2
• Molecular Weight: 137.138
• Hs Code.: 2933399090
• European Community (EC) Number: 607-404-1
• NSC Number: 358369
• DSSTox Substance ID: DTXSID80320359
• Nikkaji Number: J703.594B
• Wikidata: Q82077453
• Mol file: 2457-50-3.mol

Synonyms:2457-50-3;1-(1-oxidopyridin-6-yl)ethanone;1-(1-oxidopyridin-1-ium-2-yl)ethanone;Ethanone, 1-(1-oxido-2-pyridinyl)-;2-Acetylpyridine 1-oxide;NSC358369;2-acetylpyridine n-oxide;2-acetylpyridine-N-oxide;2-acetyl-pyridine-N-oxide;SCHEMBL4833163;DTXSID80320359;NSC-358369;Ethanone,1-(1-oxido-2-pyridinyl)-(9ci)

Chemical Property of 1-(1-Oxidopyridin-6-yl)ethanone

Chemical Property:

• Vapor Pressure: 5.44E-05mmHg at 25°C
• Melting Point: 35-36 °C
• Boiling Point: 347.3°Cat760mmHg
• PKA: -1.01±0.10(Predicted)
• Flash Point: 163.8°C
• PSA: 42.53000
• Density: 1.13g/cm³
• LogP: 1.31770
• XLogP3: -0.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 137.047678466
• Heavy Atom Count: 10
• Complexity: 136

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)C1=CC=CC=[N+]1[O-]