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93703-24-3

93703-24-3 structural image
Product Name: 8-Bromo-3-methyl-xanthine
Formula: C6H5BrN4O2
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COMPUTED DESCRIPTORS

Molecular Weight 245.03 g/mol
XLogP3 0.3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 0
Exact Mass 243.95959 g/mol
Monoisotopic Mass 243.95959 g/mol
Topological Polar Surface Area 78.1 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 271
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

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