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132898-81-8

132898-81-8 structural image
Product Name: 3-Pyridinecarbonitrile, 2-ethynyl- (9CI)
Formula: C8H4N2
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COMPUTED DESCRIPTORS

Molecular Weight 128.13 g/mol
XLogP3 0.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 1
Exact Mass 128.037448136 g/mol
Monoisotopic Mass 128.037448136 g/mol
Topological Polar Surface Area 36.7 Ų
Heavy Atom Count 10
Formal Charge 0
Complexity 202
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