3-Methyl-5-(3-methylbutyl)pyrazin-2(1H)-one

Base Information

• Chemical Name: 3-Methyl-5-(3-methylbutyl)pyrazin-2(1H)-one
• CAS No.: 78246-09-0
• Molecular Formula: C10H16 N2 O
• Molecular Weight: 0
• DSSTox Substance ID: DTXSID30516144
• Wikidata: Q82377424
• Mol file: 78246-09-0.mol

Synonyms:78246-09-0;2(1H)-Pyrazinone,3-methyl-5-(3-methylbutyl)-(9CI);3-METHYL-5-(3-METHYLBUTYL)PYRAZIN-2(1H)-ONE;DTXSID30516144

Chemical Property of 3-Methyl-5-(3-methylbutyl)pyrazin-2(1H)-one

Chemical Property:

• PSA: 45.75000
• LogP: 1.66690
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 180.126263138
• Heavy Atom Count: 13
• Complexity: 264

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NC(=CNC1=O)CCC(C)C