| CAS Number | 69374-79-4 |
| Catalog Number | AG003O0T(AGN-PC-03L3IG) |
| Chemical Name | 2-(4-Bromophenyl)-2-oxoacetamide |
| IUPAC Name | 2-(4-bromophenyl)-2-oxoacetamide |
| InChI | InChI=1S/C8H6BrNO2/c9-6-3-1-5(2-4-6)7(11)8(10)12/h1-4H,(H2,10,12) |
| InChI Key | ZLEVNHMPPZPHOU-UHFFFAOYSA-N |
| MDL Number | MFCD22581277 |
| Molecular Formula | C8H6BrNO2 |
| Molecular Weight | 228.0427 |
| SMILES | NC(=O)C(=O)C1=CC=C(Br)C=C1 |
| Synonyms | 2-(4-Bromophenyl)-2-oxoacetamide,
69374-79-4,
2-(4-BroMo-phenyl)-2-oxo-acetaMide,
ACMC-20acwt,
SCHEMBL2790202,
CTK8C2033,
DTXSID40622947,
Benzeneacetamide, 4-bromo- -oxo-,
ANW-67659,
MFCD22581277,
ZINC82038103,
AKOS016006642,
RTR-037509,
KS-000000L8,
AJ-124125,
ST2403934,
4CH-000416,
J3.543.685E,
ACN-030199,
|
| Complexity | 197 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 226.958g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 228.045g/mol |
| Monoisotopic Mass | 226.958g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 60.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number