| CAS Number | 923138-87-8 |
| Catalog Number | AG0067ZK(AGN-PC-0WCYGW) |
| Chemical Name | 2-Bromo-4-fluoro-N-methylbenzamide |
| EC Number | 928-857-4 |
| IUPAC Name | 2-bromo-4-fluoro-N-methylbenzamide |
| InChI | InChI=1S/C8H7BrFNO/c1-11-8(12)6-3-2-5(10)4-7(6)9/h2-4H,1H3,(H,11,12) |
| InChI Key | FLTQCBCOHJWXTO-UHFFFAOYSA-N |
| MDL Number | MFCD08895950 |
| Molecular Formula | C8H7BrFNO |
| Molecular Weight | 232.0497 |
| SMILES | O=C(NC)C1=CC=C(F)C=C1Br |
| Synonyms | 2-BROMO-4-FLUORO-N-METHYLBENZAMIDE,
923138-87-8,
N-methyl-2-bromo-4-fluorobenzamide,
SCHEMBL7981585,
CTK5H1136,
DTXSID30589616,
ZINC9494829,
MFCD08895950,
AKOS000196813,
AS-9763,
AS02440,
MCULE-8324565280,
Benzamide, 2-bromo-4-fluoro-N-methyl-,
N-METHYL 2-BROMO-4-FLUOROBENZAMIDE,
CS-0061779,
Y5123,
C8H7BrFNO,
2-bromo-4-fluorobenzamide,
1006-40-2,
|
| Complexity | 176 |
| 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 | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number