| CAS Number | 1156542-30-1 |
| Catalog Number | AG008WP5 |
| Chemical Name | 2-Bromo-5-fluoro-4-(trifluoromethyl)pyridine |
| IUPAC Name | 2-bromo-5-fluoro-4-(trifluoromethyl)pyridine |
| InChI | InChI=1S/C6H2BrF4N/c7-5-1-3(6(9,10)11)4(8)2-12-5/h1-2H |
| InChI Key | CFKUMEAWTPZERA-UHFFFAOYSA-N |
| MDL Number | MFCD18259807 |
| Molecular Formula | C6H2BrF4N |
| Molecular Weight | 243.9844 |
| SMILES | Brc1ncc(c(c1)C(F)(F)F)F |
| Synonyms | 2-bromo-5-fluoro-4-(trifluoromethyl)pyridine,
1156542-30-1,
2-Bromo-5-fluoro-4-trifluoromethylpyridine,
SCHEMBL2332252,
CFKUMEAWTPZERA-UHFFFAOYSA-N,
ZINC67802794,
AKOS023838750,
ACN-047818,
AK312702,
DS-11848,
CS-0103524,
F10129,
Pyridine, 2-bromo-5-fluoro-4-(trifluoromethyl)-,
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| Complexity | 160 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 242.93067g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 243.98g/mol |
| Monoisotopic Mass | 242.93067g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 12.9Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number