4,4'-(Heptane-1,1-diyl)di(1,2-dihydro-3H-pyrazol-3-one)

Base Information

• Chemical Name: 4,4'-(Heptane-1,1-diyl)di(1,2-dihydro-3H-pyrazol-3-one)
• CAS No.: 80936-04-5
• Molecular Formula: C13H20N4O2
• DSSTox Substance ID: DTXSID60559746
• Wikidata: Q82442580

Synonyms:80936-04-5;DTXSID60559746;4,4'-(Heptane-1,1-diyl)di(1,2-dihydro-3H-pyrazol-3-one)

Chemical Property of 4,4'-(Heptane-1,1-diyl)di(1,2-dihydro-3H-pyrazol-3-one)

Chemical Property:

• XLogP3: 2.5
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 264.15862589
• Heavy Atom Count: 19
• Complexity: 394

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCC(C1=CNNC1=O)C2=CNNC2=O

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