| CAS Number | 1803566-53-1 |
| Catalog Number | AG01B9WX |
| Chemical Name | Methyl 1-(3-bromo-5-fluorophenyl)cyclopropane-1-carboxylate |
| IUPAC Name | methyl 1-(3-bromo-5-fluorophenyl)cyclopropane-1-carboxylate |
| InChI | InChI=1S/C11H10BrFO2/c1-15-10(14)11(2-3-11)7-4-8(12)6-9(13)5-7/h4-6H,2-3H2,1H3 |
| InChI Key | BRCKPPXXLUSYAW-UHFFFAOYSA-N |
| MDL Number | MFCD28397432 |
| Molecular Formula | C11H10BrFO2 |
| Molecular Weight | 273.0983 |
| SMILES | O=C(C1(C2=CC(F)=CC(Br)=C2)CC1)OC |
| Synonyms | methyl 1-(3-bromo-5-fluorophenyl)cyclopropane-1-carboxylate,
1803566-53-1,
ZINC238850447,
|
| Complexity | 265 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 271.985g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 273.101g/mol |
| Monoisotopic Mass | 271.985g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number