| CAS Number | 1329457-16-0 |
| Catalog Number | AG009WWZ |
| Chemical Name | 4-(3-Bromo-5-fluorobenzoyl)morpholine |
| IUPAC Name | (3-bromo-5-fluorophenyl)-morpholin-4-ylmethanone |
| InChI | InChI=1S/C11H11BrFNO2/c12-9-5-8(6-10(13)7-9)11(15)14-1-3-16-4-2-14/h5-7H,1-4H2 |
| InChI Key | GKWMVMQVKKECNY-UHFFFAOYSA-N |
| MDL Number | MFCD20046060 |
| Molecular Formula | C11H11BrFNO2 |
| Molecular Weight | 288.1129 |
| SMILES | Fc1cc(Br)cc(c1)C(=O)N1CCOCC1 |
| Synonyms | 4-(3-Bromo-5-fluorobenzoyl)morpholine,
1329457-16-0,
ZINC46571231,
AKOS009469960,
Z9665,
C11H11BrFNO2,
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| Complexity | 258 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 286.996g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 288.116g/mol |
| Monoisotopic Mass | 286.996g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number