| CAS Number | 854583-85-0 |
| Catalog Number | AG00G9MS(AGN-PC-00ZRST) |
| Chemical Name | AcetaMide, N-(4-broMo-2-nitrophenyl)-2-chloro- |
| IUPAC Name | N-(4-bromo-2-nitrophenyl)-2-chloroacetamide |
| InChI | InChI=1S/C8H6BrClN2O3/c9-5-1-2-6(11-8(13)4-10)7(3-5)12(14)15/h1-3H,4H2,(H,11,13) |
| InChI Key | WRKSGYQIJTUHEG-UHFFFAOYSA-N |
| MDL Number | MFCD07468929 |
| Molecular Formula | C8H6BrClN2O3 |
| Molecular Weight | 293.5018 |
| SMILES | [O-][N+](=O)C1=CC(Br)=CC=C1NC(=O)CCl |
| Synonyms | N-(4-bromo-2-nitrophenyl)-2-chloroacetamide,
854583-85-0,
C8H6BrClN2O3,
SCHEMBL1762404,
DTXSID60586092,
WRKSGYQIJTUHEG-UHFFFAOYSA-N,
ZINC8569608,
KM2325,
MFCD07468929,
AKOS000295689,
AJ-57630,
AS-45806,
ST50758925,
V8101,
Acetamide, N-(4-bromo-2-nitrophenyl)-2-chloro-,
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| Complexity | 259 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 291.925g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 293.501g/mol |
| Monoisotopic Mass | 291.925g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 74.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number