| CAS Number | 40371-61-7 |
| Catalog Number | AG00D6BV(AGN-PC-00EJYE) |
| Chemical Name | N-(3-Bromo-4-methylphenyl)acetamide |
| IUPAC Name | N-(3-bromo-4-methylphenyl)acetamide |
| InChI | InChI=1S/C9H10BrNO/c1-6-3-4-8(5-9(6)10)11-7(2)12/h3-5H,1-2H3,(H,11,12) |
| InChI Key | KEVGOMKRAFQTBF-UHFFFAOYSA-N |
| MDL Number | MFCD01047359 |
| Molecular Formula | C9H10BrNO |
| Molecular Weight | 228.0858 |
| SMILES | CC(NC1=CC(Br)=C(C)C=C1)=O |
| Synonyms | N-(3-Bromo-4-methylphenyl)acetamide,
40371-61-7,
N-(3-bromo-4-methylphenyl)-acetamide,
3'-Bromo-4'-methylacetanilide,
SCHEMBL2556808,
CTK1D4608,
DTXSID10470937,
KEVGOMKRAFQTBF-UHFFFAOYSA-N,
N-acetyl-3-bromo-4-methylaniline,
ZINC59458995,
AKOS003632061,
AB07992,
Acetamide, N-(3-bromo-4-methylphenyl)-,
Z296850122,
N-(3-bromo-4-methyl-phenyl)acetamide,
CID11708413,
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| Complexity | 172 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 226.995g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 228.089g/mol |
| Monoisotopic Mass | 226.995g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number