| CAS Number | 90221-50-4 |
| Catalog Number | AG00IG1R(AGN-PC-03IBRT) |
| Chemical Name | N-(2-Bromo-5-nitrophenyl)acetamide |
| IUPAC Name | N-(2-bromo-5-nitrophenyl)acetamide |
| InChI | InChI=1S/C8H7BrN2O3/c1-5(12)10-8-4-6(11(13)14)2-3-7(8)9/h2-4H,1H3,(H,10,12) |
| InChI Key | RTSTZQRSWJGBNU-UHFFFAOYSA-N |
| MDL Number | MFCD01055973 |
| Molecular Formula | C8H7BrN2O3 |
| Molecular Weight | 259.0568 |
| SMILES | CC(=O)Nc1cc(ccc1Br)[N+](=O)[O-] |
| Synonyms | N-(2-BROMO-5-NITROPHENYL)ACETAMIDE,
90221-50-4,
Acetamide, N-(2-bromo-5-nitrophenyl)-,
SCHEMBL396053,
DTXSID50620818,
RTSTZQRSWJGBNU-UHFFFAOYSA-N,
N-(2-bromo-5-nitropheny)acetamide,
ZINC75282617,
AKOS016615599,
AB08004,
42460-EP2311808A1,
42460-EP2311829A1,
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| Complexity | 241 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 257.964g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 259.059g/mol |
| Monoisotopic Mass | 257.964g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 74.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number