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131002-09-0

131002-09-0 structural image
Product Name: 6-chloroisoquinolin-1(2H)-one
Formula: C9H6ClNO
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COMPUTED DESCRIPTORS

Molecular Weight 179.60 g/mol
XLogP3 2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 0
Exact Mass 179.0137915 g/mol
Monoisotopic Mass 179.0137915 g/mol
Topological Polar Surface Area 29.1 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 227
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