| CAS Number | 2090789-78-7 |
| Catalog Number | AG01DW6K |
| Chemical Name | 1-(4-bromo-2-ethoxy-6-fluorophenyl)ethan-1-one |
| IUPAC Name | 1-(4-bromo-2-ethoxy-6-fluorophenyl)ethanone |
| InChI | InChI=1S/C10H10BrFO2/c1-3-14-9-5-7(11)4-8(12)10(9)6(2)13/h4-5H,3H2,1-2H3 |
| InChI Key | BFIAVGGIJACPOP-UHFFFAOYSA-N |
| MDL Number | MFCD30469009 |
| Molecular Formula | C10H10BrFO2 |
| Molecular Weight | 261.0876 |
| SMILES | CCOC1=C(C(C)=O)C(F)=CC(Br)=C1 |
| Synonyms | 1-(4-bromo-2-ethoxy-6-fluorophenyl)ethan-1-one,
2090789-78-7,
AKOS034130818,
|
| Complexity | 210 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 259.985g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 261.09g/mol |
| Monoisotopic Mass | 259.985g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number