850349-70-1
Product Name:
(5-BROMO-3,4-DIMETHOXY-PYRIDIN-2-YL)-ACETONITRILE
Formula:
C9H9BrN2O2
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COMPUTED DESCRIPTORS
Molecular Weight | 257.08 g/mol |
---|---|
XLogP3 | 1.2 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 3 |
Exact Mass | 255.98474 g/mol |
Monoisotopic Mass | 255.98474 g/mol |
Topological Polar Surface Area | 55.1 Ų |
Heavy Atom Count | 14 |
Formal Charge | 0 |
Complexity | 228 |
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 |