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22404-42-8

22404-42-8 structural image
Product Name: 2,4-Pyrimidinediamine, N2-methyl- (9CI)
Formula: C5H8N4
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COMPUTED DESCRIPTORS

Molecular Weight 124.14 g/mol
XLogP3 0.2
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 1
Exact Mass 124.074896272 g/mol
Monoisotopic Mass 124.074896272 g/mol
Topological Polar Surface Area 63.8 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 85
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