| CAS Number | 855927-64-9 |
| Catalog Number | AG00IDPR(AGN-PC-0WP1TY) |
| Chemical Name | 2-(2-Bromophenyl)-N-(2-hydroxyethyl)acetamide |
| IUPAC Name | 2-(2-bromophenyl)-N-(2-hydroxyethyl)acetamide |
| InChI | InChI=1S/C10H12BrNO2/c11-9-4-2-1-3-8(9)7-10(14)12-5-6-13/h1-4,13H,5-7H2,(H,12,14) |
| InChI Key | HZOSIHSERGVSCS-UHFFFAOYSA-N |
| MDL Number | MFCD29043336 |
| Molecular Formula | C10H12BrNO2 |
| Molecular Weight | 258.1118 |
| SMILES | OCCNC(=O)Cc1ccccc1Br |
| Synonyms | 2-(2-Bromophenyl)-N-(2-hydroxyethyl)acetamide,
855927-64-9,
ZINC169825272,
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| Complexity | 187 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 257.005g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 258.115g/mol |
| Monoisotopic Mass | 257.005g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 49.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
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Certificate of Analysis
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