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87095-89-4

87095-89-4 structural image
Product Name: trans-1,2-Cyclohexylenedinitrotetraacetic acid hydrate
Formula: C14H24N2O9
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COMPUTED DESCRIPTORS

Molecular Weight 364.35 g/mol
Hydrogen Bond Donor Count 5
Hydrogen Bond Acceptor Count 11
Rotatable Bond Count 10
Exact Mass 364.14818035 g/mol
Monoisotopic Mass 364.14818035 g/mol
Topological Polar Surface Area 180 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 477
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes