| CAS Number | 1341736-93-3 |
| Catalog Number | AG01BEUX |
| Chemical Name | [4-bromo-2-(trifluoromethyl)phenyl](cyclopropyl)methanone |
| IUPAC Name | [4-bromo-2-(trifluoromethyl)phenyl]-cyclopropylmethanone |
| InChI | InChI=1S/C11H8BrF3O/c12-7-3-4-8(10(16)6-1-2-6)9(5-7)11(13,14)15/h3-6H,1-2H2 |
| InChI Key | FJBPGXYEYDPQHI-UHFFFAOYSA-N |
| MDL Number | MFCD20335963 |
| Molecular Formula | C11H8BrF3O |
| Molecular Weight | 293.0798 |
| SMILES | FC(C1=C(C(C2CC2)=O)C=CC(Br)=C1)(F)F |
| Synonyms | [4-bromo-2-(trifluoromethyl)phenyl](cyclopropyl)methanone,
1341736-93-3,
ZINC70735811,
AKOS013813564,
NE24921,
|
| Complexity | 285 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 291.971g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 293.083g/mol |
| Monoisotopic Mass | 291.971g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 17.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number