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28321-49-5

28321-49-5 structural image
Product Name: 5-AMINO-ISOPHTHALAMIDE
Formula: C8H9N3O2
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COMPUTED DESCRIPTORS

Molecular Weight 179.18 g/mol
XLogP3 -1
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 179.069476538 g/mol
Monoisotopic Mass 179.069476538 g/mol
Topological Polar Surface Area 112 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 207
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