| CAS Number | 1859653-04-5 |
| Catalog Number | AG01DZ5K |
| Chemical Name | [5-bromo-2-(2,2-difluoroethoxy)pyridin-4-yl]methanol |
| IUPAC Name | [5-bromo-2-(2,2-difluoroethoxy)pyridin-4-yl]methanol |
| InChI | InChI=1S/C8H8BrF2NO2/c9-6-2-12-8(1-5(6)3-13)14-4-7(10)11/h1-2,7,13H,3-4H2 |
| InChI Key | ZCJIYFBKGGCQPI-UHFFFAOYSA-N |
| MDL Number | MFCD31616106 |
| Molecular Formula | C8H8BrF2NO2 |
| Molecular Weight | 268.0554 |
| SMILES | OCC1=C(Br)C=NC(OCC(F)F)=C1 |
| Synonyms | [5-bromo-2-(2,2-difluoroethoxy)pyridin-4-yl]methanol,
1859653-04-5,
|
| Complexity | 173 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 266.971g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 268.058g/mol |
| Monoisotopic Mass | 266.971g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 42.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
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