| CAS Number | 1784354-70-6 |
| Catalog Number | AG01DYXY |
| Chemical Name | 1-(3-bromophenyl)-2-fluoroethan-1-ol |
| IUPAC Name | 1-(3-bromophenyl)-2-fluoroethanol |
| InChI | InChI=1S/C8H8BrFO/c9-7-3-1-2-6(4-7)8(11)5-10/h1-4,8,11H,5H2 |
| InChI Key | LSBQSNZQLODXPJ-UHFFFAOYSA-N |
| MDL Number | MFCD28543659 |
| Molecular Formula | C8H8BrFO |
| Molecular Weight | 219.0509 |
| SMILES | OC(C1=CC(Br)=CC=C1)CF |
| Synonyms | 1-(3-bromophenyl)-2-fluoroethan-1-ol,
1784354-70-6,
SCHEMBL1599837,
AKOS024153392,
|
| Complexity | 121 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 217.974g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 219.053g/mol |
| Monoisotopic Mass | 217.974g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
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Certificate of Analysis
Lot Number