| CAS Number | 370879-86-0 |
| Catalog Number | AG01BK8C |
| Chemical Name | 3-bromo-5-(2,2,2-trifluoroethoxy)pyridine |
| IUPAC Name | 3-bromo-5-(2,2,2-trifluoroethoxy)pyridine |
| InChI | InChI=1S/C7H5BrF3NO/c8-5-1-6(3-12-2-5)13-4-7(9,10)11/h1-3H,4H2 |
| InChI Key | ZMZNDPYHFGGPTR-UHFFFAOYSA-N |
| MDL Number | MFCD19674073 |
| Molecular Formula | C7H5BrF3NO |
| Molecular Weight | 256.0199 |
| SMILES | FC(COC1=CC(Br)=CN=C1)(F)F |
| Synonyms | 3-bromo-5-(2,2,2-trifluoroethoxy)pyridine,
370879-86-0,
SCHEMBL651977,
ZMZNDPYHFGGPTR-UHFFFAOYSA-N,
AKOS013527462,
3-Bromo-5-(2,2,2-trifluoro-ethoxy)-pyridine,
113009-EP2295437A1,
113009-EP2298775A1,
|
| Complexity | 164 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 254.951g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 256.022g/mol |
| Monoisotopic Mass | 254.951g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 22.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number