| CAS Number | 633335-80-5 |
| Catalog Number | AG00EKPB(AGN-PC-03Y3J3) |
| Chemical Name | N-(4-Bromo-5-Fluoro-2-Methylphenyl)Acetamide |
| IUPAC Name | N-(4-bromo-5-fluoro-2-methylphenyl)acetamide |
| InChI | InChI=1S/C9H9BrFNO/c1-5-3-7(10)8(11)4-9(5)12-6(2)13/h3-4H,1-2H3,(H,12,13) |
| InChI Key | KCEWAUIVDCPPQJ-UHFFFAOYSA-N |
| MDL Number | MFCD22989047 |
| Molecular Formula | C9H9BrFNO |
| Molecular Weight | 246.0763 |
| SMILES | BrC1=CC(=C(C=C1F)NC(C)=O)C |
| Synonyms | N-(4-Bromo-5-fluoro-2-methylphenyl)acetamide,
633335-80-5,
Acetamide, N-(4-bromo-5-fluoro-2-methylphenyl)-,
SCHEMBL377108,
CTK2A9450,
KS-00001AMW,
DTXSID60630226,
KCEWAUIVDCPPQJ-UHFFFAOYSA-N,
MFCD22989047,
ZINC89157361,
CS-0038907,
V7022,
L-1484,
C9H9BrFNO,
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| Complexity | 200 |
| 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 | 1 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number