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898786-19-1

898786-19-1 structural image
Product Name: 6-CHLORO-1-(4-CYANOPHENYL)-1-OXOHEXANE
Formula: C13H14ClNO
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COMPUTED DESCRIPTORS

Molecular Weight 235.71 g/mol
XLogP3 2.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 6
Exact Mass 235.0763918 g/mol
Monoisotopic Mass 235.0763918 g/mol
Topological Polar Surface Area 40.9 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 260
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