| CAS Number | 1249090-53-6 |
| Catalog Number | AG01AK9B |
| Chemical Name | ethyl 2-(4-bromo-2-fluorophenyl)-2-chloroacetate |
| IUPAC Name | ethyl 2-(4-bromo-2-fluorophenyl)-2-chloroacetate |
| InChI | InChI=1S/C10H9BrClFO2/c1-2-15-10(14)9(12)7-4-3-6(11)5-8(7)13/h3-5,9H,2H2,1H3 |
| InChI Key | FMNGZOYGXDOZJW-UHFFFAOYSA-N |
| MDL Number | MFCD16694315 |
| Molecular Formula | C10H9BrClFO2 |
| Molecular Weight | 295.5327 |
| SMILES | CCOC(C(C1=C(F)C=C(Br)C=C1)Cl)=O |
| Synonyms | ethyl 2-(4-bromo-2-fluorophenyl)-2-chloroacetate,
1249090-53-6,
AKOS011505992,
NE23294,
EN300-83108,
|
| Complexity | 228 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 293.946g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 295.532g/mol |
| Monoisotopic Mass | 293.946g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.6 |
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