98557-68-7
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 |