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4786-35-0

4786-35-0 structural image
Product Name: 2-Pentenenitrile, 3-methyl-
Formula: C6H9N
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COMPUTED DESCRIPTORS

Molecular Weight 95.14 g/mol
XLogP3 1.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 1
Exact Mass 95.073499291 g/mol
Monoisotopic Mass 95.073499291 g/mol
Topological Polar Surface Area 23.8 Ų
Heavy Atom Count 7
Formal Charge 0
Complexity 113
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 1
Compound Is Canonicalized Yes