| CAS Number | 1505238-87-8 |
| Catalog Number | AG01BVJX |
| Chemical Name | 3-bromo-2-fluoro-5-methylbenzamide |
| IUPAC Name | 3-bromo-2-fluoro-5-methylbenzamide |
| InChI | InChI=1S/C8H7BrFNO/c1-4-2-5(8(11)12)7(10)6(9)3-4/h2-3H,1H3,(H2,11,12) |
| InChI Key | HUAHYBZBHGOZHJ-UHFFFAOYSA-N |
| MDL Number | MFCD30486621 |
| Molecular Formula | C8H7BrFNO |
| Molecular Weight | 232.0497 |
| SMILES | BrC=1C(=C(C(=O)N)C=C(C1)C)F |
| Synonyms | 3-bromo-2-fluoro-5-methylbenzamide,
1505238-87-8,
SCHEMBL17185659,
ZINC75915032,
AKOS023125885,
Z2692095207,
|
| Complexity | 188 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 230.97g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 232.052g/mol |
| Monoisotopic Mass | 230.97g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 43.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number