954238-43-8
Product Name:
2-(4-BROMO-PHENYL)-4,4,4-TRIFLUORO-3-OXO-BUTYRONITRILE
Formula:
C10H5BrF3NO
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COMPUTED DESCRIPTORS
Molecular Weight | 292.05 g/mol |
---|---|
XLogP3 | 3.3 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 2 |
Exact Mass | 290.95066 g/mol |
Monoisotopic Mass | 290.95066 g/mol |
Topological Polar Surface Area | 40.9 Ų |
Heavy Atom Count | 16 |
Formal Charge | 0 |
Complexity | 312 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |