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98557-68-7

98557-68-7 structural image
Product Name: 9H-Purine-6-carboxylic acid, 2-chloro-9-(2-chloroethyl)-
Formula: C8H6Cl2N4O2
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COMPUTED DESCRIPTORS

Molecular Weight 261.06 g/mol
XLogP3 1.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 259.9867808 g/mol
Monoisotopic Mass 259.9867808 g/mol
Topological Polar Surface Area 80.9 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 281
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