2-[(3-Amino-1,2-benzisoxazol-4-yl)oxy]acetonitrile

Base Information

• Chemical Name: 2-[(3-Amino-1,2-benzisoxazol-4-yl)oxy]acetonitrile
• CAS No.: 126940-16-7
• Molecular Formula: C₉H₇N₃O₂
• Molecular Weight: 189.173
• DSSTox Substance ID: DTXSID901228903

Synonyms:126940-16-7;2-[(3-Amino-1,2-benzisoxazol-4-yl)oxy]acetonitrile;SCHEMBL10422419;DTXSID901228903

Chemical Property of 2-[(3-Amino-1,2-benzisoxazol-4-yl)oxy]acetonitrile

Chemical Property:

• XLogP3: 1.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 189.053826475
• Heavy Atom Count: 14
• Complexity: 250

Purity/Quality:

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MSDS Files:

Useful:

• Canonical SMILES: C1=CC2=C(C(=C1)OCC#N)C(=NO2)N

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