| CAS Number | 1461705-99-6 |
| Catalog Number | AG01A6M5 |
| Chemical Name | 2-bromo-3-(4-fluorophenyl)propanamide |
| IUPAC Name | 2-bromo-3-(4-fluorophenyl)propanamide |
| InChI | InChI=1S/C9H9BrFNO/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8H,5H2,(H2,12,13) |
| InChI Key | ISLSMDMOUXWHQC-UHFFFAOYSA-N |
| MDL Number | MFCD25970352 |
| Molecular Formula | C9H9BrFNO |
| Molecular Weight | 246.0763 |
| SMILES | NC(C(CC1=CC=C(F)C=C1)Br)=O |
| Synonyms | 2-bromo-3-(4-fluorophenyl)propanamide,
1461705-99-6,
FCH5045861,
NE17185,
BBV-50408470,
EN300-133443,
|
| Complexity | 181 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 244.985g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 246.079g/mol |
| Monoisotopic Mass | 244.985g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 43.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number