| CAS Number | 2007908-49-6 |
| Catalog Number | AG01DIIK |
| Chemical Name | 2-Bromo-1-(4-chlorophenyl)-2-cyclopropylethanone |
| IUPAC Name | 2-bromo-1-(4-chlorophenyl)-2-cyclopropylethanone |
| InChI | InChI=1S/C11H10BrClO/c12-10(7-1-2-7)11(14)8-3-5-9(13)6-4-8/h3-7,10H,1-2H2 |
| InChI Key | SOTOZENXLQNZJM-UHFFFAOYSA-N |
| MDL Number | MFCD30472050 |
| Molecular Formula | C11H10BrClO |
| Molecular Weight | 273.5535 |
| SMILES | Clc1ccc(cc1)C(=O)C(Br)C1CC1 |
| Synonyms | 2-Bromo-1-(4-chlorophenyl)-2-cyclopropylethanone,
2007908-49-6,
SCHEMBL18527262,
MFCD30472050,
AKOS030628329,
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| Complexity | 219 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 271.96g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 273.554g/mol |
| Monoisotopic Mass | 271.96g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 17.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.8 |
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Certificate of Analysis
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