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35013-90-2

35013-90-2 structural image
Product Name: 4-[CYANO(HYDROXYAMINO)METHYL]-1-METHYLPYRIDINIUM IODIDE
Formula: C8H8IN3O
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COMPUTED DESCRIPTORS

Molecular Weight 289.07 g/mol
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 1
Exact Mass 288.97121 g/mol
Monoisotopic Mass 288.97121 g/mol
Topological Polar Surface Area 60.3 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 220
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 1
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes