| CAS Number | 443122-64-3 |
| Catalog Number | AG00DCTV(AGN-PC-0WB4B7) |
| Chemical Name | N-(2-bromophenyl)butanamide |
| IUPAC Name | N-(2-bromophenyl)butanamide |
| InChI | InChI=1S/C10H12BrNO/c1-2-5-10(13)12-9-7-4-3-6-8(9)11/h3-4,6-7H,2,5H2,1H3,(H,12,13) |
| InChI Key | MZTDZSQKBXRTNL-UHFFFAOYSA-N |
| MDL Number | MFCD00462544 |
| Molecular Formula | C10H12BrNO |
| Molecular Weight | 242.1124 |
| SMILES | N(C(CCC)=O)C1=CC=CC=C1Br |
| Synonyms | N-(2-bromophenyl)butanamide,
443122-64-3,
N-(2-Bromophenyl)butyramide,
AC1LE9IR,
CTK4I8100,
DTXSID50352682,
ZINC146675,
MFCD00462544,
AKOS000182180,
MCULE-7963115716,
AJ-12547,
ST50322606,
W-7070,
AG-690/03037030,
N- butanamide,
CID732405,
ZINC00146675,
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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 | 241.01g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 242.116g/mol |
| Monoisotopic Mass | 241.01g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number