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5167-62-4

5167-62-4 structural image
Product Name: 3-Butenenitrile, 2-methylene-
Formula: C5H5N
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COMPUTED DESCRIPTORS

Molecular Weight 490.01 g/mol
XLogP3 3.6
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 3
Exact Mass 489.84704 g/mol
Monoisotopic Mass 487.84909 g/mol
Topological Polar Surface Area 166 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 555
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes