5-Methyl-3,4-dihydropyridin-2(1H)-one

Base Information

• Chemical Name: 5-Methyl-3,4-dihydropyridin-2(1H)-one
• CAS No.: 91936-25-3
• Molecular Formula: C6H9NO
• Molecular Weight: 111.144
• DSSTox Substance ID: DTXSID90538281
• Nikkaji Number: J376.895C
• Wikidata: Q82413593
• Mol file: 91936-25-3.mol

Synonyms:91936-25-3;5-Methyl-3,4-dihydropyridin-2(1H)-one;SCHEMBL10523922;DTXSID90538281;AKOS006348553

Chemical Property of 5-Methyl-3,4-dihydropyridin-2(1H)-one

Chemical Property:

• PSA: 32.59000
• LogP: 1.07610
• XLogP3: -0.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 111.068413911
• Heavy Atom Count: 8
• Complexity: 138

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=CNC(=O)CC1