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1189931-96-1

1189931-96-1 structural image
Product Name: LUMINOL-13C4
Formula: C8H7N3O2
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COMPUTED DESCRIPTORS

Molecular Weight 181.13 g/mol
XLogP3 0.3
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 0
Exact Mass 181.06724582 g/mol
Monoisotopic Mass 181.06724582 g/mol
Topological Polar Surface Area 84.2 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 254
Isotope Atom Count 4
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