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586996-09-0

586996-09-0 structural image
Product Name: 4,6-DIBROMO-2-(3-IODOPHENYL)-1,3-BENZOXAZOL-5-AMINE
Formula: C13H7Br2IN2O
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COMPUTED DESCRIPTORS

Molecular Weight 493.92 g/mol
XLogP3 4.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 493.79494 g/mol
Monoisotopic Mass 491.79699 g/mol
Topological Polar Surface Area 52 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 336
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