| CAS Number | 851010-92-9 |
| Catalog Number | AG01AFGW(AGN-PC-080HYG) |
| Chemical Name | N-(2-bromo-4-fluorophenyl)-2,2,2-trifluoroacetamide |
| IUPAC Name | N-(2-bromo-4-fluorophenyl)-2,2,2-trifluoroacetamide |
| InChI | InChI=1S/C8H4BrF4NO/c9-5-3-4(10)1-2-6(5)14-7(15)8(11,12)13/h1-3H,(H,14,15) |
| InChI Key | OKSCLPLKGUGUBM-UHFFFAOYSA-N |
| MDL Number | MFCD12819942 |
| Molecular Formula | C8H4BrF4NO |
| Molecular Weight | 286.0211 |
| SMILES | FC1=CC(Br)=C(NC(C(F)(F)F)=O)C=C1 |
| Synonyms | N-(2-bromo-4-fluorophenyl)-2,2,2-trifluoroacetamide,
851010-92-9,
ZINC38003857,
AKOS006039954,
NE15581,
|
| Complexity | 245 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 284.941g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 286.024g/mol |
| Monoisotopic Mass | 284.941g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
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Certificate of Analysis
Lot Number