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6328-00-3

6328-00-3 structural image
Product Name: 3-NITRO-GAMMA-OXO-BENZENEBUTANOIC ACID
Formula: C10H9NO5
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COMPUTED DESCRIPTORS

Molecular Weight 223.18 g/mol
XLogP3 1.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 223.04807239 g/mol
Monoisotopic Mass 223.04807239 g/mol
Topological Polar Surface Area 100 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 296
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