| CAS Number | 1220124-43-5 |
| Catalog Number | AG01EL9V |
| Chemical Name | (3-bromophenyl)[3-(trifluoromethyl)phenyl]methanone |
| IUPAC Name | (3-bromophenyl)-[3-(trifluoromethyl)phenyl]methanone |
| InChI | InChI=1S/C14H8BrF3O/c15-12-6-2-4-10(8-12)13(19)9-3-1-5-11(7-9)14(16,17)18/h1-8H |
| InChI Key | ZGLXSWHFUWZJFJ-UHFFFAOYSA-N |
| MDL Number | MFCD18573934 |
| Molecular Formula | C14H8BrF3O |
| Molecular Weight | 329.1119 |
| SMILES | FC(C1=CC(C(C2=CC(Br)=CC=C2)=O)=CC=C1)(F)F |
| Synonyms | AKOS012718719,
ZINC109708988,
(3-bromophenyl)[3-(trifluoromethyl)phenyl]methanone,
1220124-43-5,
|
| Complexity | 329 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 327.971g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 329.116g/mol |
| Monoisotopic Mass | 327.971g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 17.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number