2-Bromo-5'-fluoro-2'-hydroxyacetophenone
TL;DR: 2-Bromo-5'-fluoro-2'-hydroxyacetophenone (CAS 126581-65-5) is a chemical compound with molecular formula C8H6BrFO2 and molecular weight 231.95352 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-bromo-1-(5-fluoro-2-hydroxyphenyl)ethanone
Also Known As: 2-Bromo-1-(5-fluoro-2-hydroxyphenyl)ethanone, 5-Fluoro-2-hydroxyphenacyl bromide, 2-Bromo-5'-fluoro-2'-hydroxyacetophenone, Ethanone, 2-bromo-1-(5-fluoro-2-hydroxyphenyl)-, 5002AH
Technical Specifications
| Molecular Formula | C8H6BrFO2 |
| Molecular Weight | 231.95352 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 231.95352 Da |
| Heavy Atoms | 12 |
| Complexity | 174.0 |
| SMILES | C1=CC(=C(C=C1F)C(=O)CBr)O |
| InChIKey | QFYYHGPQMZTLRB-UHFFFAOYSA-N |
Chemical Property Profile of 2-Bromo-5'-fluoro-2'-hydroxyacetophenone
Property Insights of 2-Bromo-5'-fluoro-2'-hydroxyacetophenone
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Bromo-5'-fluoro-2'-hydroxyacetophenone. With a topological polar surface area (TPSA) of 37.3 Ų, 2-Bromo-5'-fluoro-2'-hydroxyacetophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromo-5'-fluoro-2'-hydroxyacetophenone has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Bromo-5'-fluoro-2'-hydroxyacetophenone?
The CAS number of 2-Bromo-5'-fluoro-2'-hydroxyacetophenone is 126581-65-5.
What is the molecular formula of 2-Bromo-5'-fluoro-2'-hydroxyacetophenone?
The molecular formula of 2-Bromo-5'-fluoro-2'-hydroxyacetophenone is C8H6BrFO2.
What is the molecular weight of 2-Bromo-5'-fluoro-2'-hydroxyacetophenone?
The molecular weight of 2-Bromo-5'-fluoro-2'-hydroxyacetophenone is 231.95352 g/mol.
Where can I buy 2-Bromo-5'-fluoro-2'-hydroxyacetophenone?
You can request a quote for 2-Bromo-5'-fluoro-2'-hydroxyacetophenone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Bromo-5'-fluoro-2'-hydroxyacetophenone?
Yes, CoreyChem provides custom synthesis services for 2-Bromo-5'-fluoro-2'-hydroxyacetophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.