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13676-48-7

13676-48-7 structural image
Product Name: 5-Amino-2-(3-aminophenyl)benzoxazole
Formula: C13H11N3O
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COMPUTED DESCRIPTORS

Molecular Weight 225.25 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 1
Exact Mass 225.090211983 g/mol
Monoisotopic Mass 225.090211983 g/mol
Topological Polar Surface Area 78.1 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 273
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