| CAS Number | 1707572-80-2 |
| Catalog Number | AG01EUCK(AGN-PC-3H47HP) |
| Chemical Name | 1-Bromo-3-[1-(trifluoromethyl)cyclopropyl]benzene |
| IUPAC Name | 1-bromo-3-[1-(trifluoromethyl)cyclopropyl]benzene |
| InChI | InChI=1S/C10H8BrF3/c11-8-3-1-2-7(6-8)9(4-5-9)10(12,13)14/h1-3,6H,4-5H2 |
| InChI Key | DNGMIQNMZJTKMF-UHFFFAOYSA-N |
| MDL Number | MFCD28134436 |
| Molecular Formula | C10H8BrF3 |
| Molecular Weight | 265.0697 |
| SMILES | BrC1=CC(=CC=C1)C1(CC1)C(F)(F)F |
| Synonyms | 1-Bromo-3-[1-(trifluoromethyl)cyclopropyl]benzene,
1707572-80-2,
SCHEMBL20467601,
ZINC98214264,
|
| Complexity | 220 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 263.976g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 265.073g/mol |
| Monoisotopic Mass | 263.976g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number