| CAS Number | 1345471-73-9 |
| Catalog Number | AG007M34(AGN-PC-0BGI99) |
| Chemical Name | 4-(4-Bromo-2-fluorophenyl)butanamide |
| IUPAC Name | 4-(4-bromo-2-fluorophenyl)butanamide |
| InChI | InChI=1S/C10H11BrFNO/c11-8-5-4-7(9(12)6-8)2-1-3-10(13)14/h4-6H,1-3H2,(H2,13,14) |
| InChI Key | XMXAVENXBUWLIC-UHFFFAOYSA-N |
| MDL Number | MFCD20441842 |
| Molecular Formula | C10H11BrFNO |
| Molecular Weight | 260.1028 |
| SMILES | NC(=O)CCCc1ccc(cc1F)Br |
| Synonyms | 4-(4-Bromo-2-fluorophenyl)butanamide,
1345471-73-9,
ACMC-209bvk,
CTK8B0243,
DTXSID20718337,
ANW-19662,
MFCD20441842,
ZINC74937745,
CJ-21757,
TC-108407,
Z9788,
C10H11BrFNO,
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| Complexity | 201 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 259.001g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 260.106g/mol |
| Monoisotopic Mass | 259.001g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 43.1A^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