4-(1,3-Benzodioxol-5-ylmethyl)-1-piperazineacetonitrile

Base Information

• Chemical Name: 4-(1,3-Benzodioxol-5-ylmethyl)-1-piperazineacetonitrile
• CAS No.: 125575-24-8
• Molecular Formula: C₁₄H₁₇N₃O₂
• Molecular Weight: 259.308
• DSSTox Substance ID: DTXSID201204534

Synonyms:DTXSID201204534;125575-24-8;4-(1,3-Benzodioxol-5-ylmethyl)-1-piperazineacetonitrile

Chemical Property of 4-(1,3-Benzodioxol-5-ylmethyl)-1-piperazineacetonitrile

Chemical Property:

• XLogP3: 1.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 259.132076794
• Heavy Atom Count: 19
• Complexity: 346

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MSDS Files:

Useful:

• Canonical SMILES: C1CN(CCN1CC#N)CC2=CC3=C(C=C2)OCO3

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