2227712-52-7
Product Name:
(S)-1-(5-bromopyridin-3-yl)-2,2,2-trifluoroethanol
Formula:
C7H5BrF3NO
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COMPUTED DESCRIPTORS
| Molecular Weight | 256.02 g/mol |
|---|---|
| XLogP3 | 1.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 1 |
| Exact Mass | 254.95066 g/mol |
| Monoisotopic Mass | 254.95066 g/mol |
| Topological Polar Surface Area | 33.1 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 176 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 1 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |