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40316-56-1

40316-56-1 structural image
Product Name: Benzene, [(3E)-5-chloro-3-penten-1-yn-1-yl]-
Formula: C11H9Cl
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COMPUTED DESCRIPTORS

Molecular Weight 176.64 g/mol
XLogP3 3.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 0
Rotatable Bond Count 2
Exact Mass 176.0392780 g/mol
Monoisotopic Mass 176.0392780 g/mol
Topological Polar Surface Area 0 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 198
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes