| CAS Number | 1542563-93-8 |
| Catalog Number | AG01DSTS |
| Chemical Name | 1-(6-Bromo-2,3-difluorophenyl)ethanone |
| IUPAC Name | 1-(6-bromo-2,3-difluorophenyl)ethanone |
| InChI | InChI=1S/C8H5BrF2O/c1-4(12)7-5(9)2-3-6(10)8(7)11/h2-3H,1H3 |
| InChI Key | LPFAUHPMXMEQSR-UHFFFAOYSA-N |
| MDL Number | MFCD26679370 |
| Molecular Formula | C8H5BrF2O |
| Molecular Weight | 235.0255 |
| SMILES | CC(=O)c1c(Br)ccc(c1F)F |
| Synonyms | 1-(6-Bromo-2,3-difluorophenyl)ethanone,
1542563-93-8,
6'-Bromo-2',3'-difluoroacetophenone,
AKOS023096131,
|
| Complexity | 186 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 233.949g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 235.028g/mol |
| Monoisotopic Mass | 233.949g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 17.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
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Certificate of Analysis
Lot Number