3'-Bromo-5'-chloro-2'-hydroxyacetophenone
TL;DR: 3'-Bromo-5'-chloro-2'-hydroxyacetophenone (CAS 59443-15-1) is a chemical compound with molecular formula C8H6BrClO2 and molecular weight 247.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-bromo-5-chloro-2-hydroxyphenyl)ethanone
Also Known As: 3'-Bromo-5'-chloro-2'-hydroxyacetophenone, 1-(3-bromo-5-chloro-2-hydroxyphenyl)ethanone, 3-bromo-5-chloro-2-hydroxyacetophenone, 3-(trifluoromethoxy)benzylbromide, 2-Acetyl-4-chloro-6-bromophenol
| Molecular Formula | C8H6BrClO2 |
|---|---|
| Molecular Weight | 247.92 g/mol |
| LogP | 3.0107 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 247.92397 |
| Heavy Atoms | 12 |
| Complexity | 336.0749 |
Chemical Identifiers
| CAS Number | 59443-15-1 |
|---|---|
| SMILES | CC(=O)C1=C(C(=CC(=C1)Cl)Br)O |
Product Overview
3'-Bromo-5'-chloro-2'-hydroxyacetophenone (CAS 59443-15-1), with molecular formula C8H6BrClO2 and molecular weight 247.92 g/mol. IUPAC: 1-(3-bromo-5-chloro-2-hydroxyphenyl)ethanone.
Chemical Property Profile of 3'-Bromo-5'-chloro-2'-hydroxyacetophenone
Property Insights of 3'-Bromo-5'-chloro-2'-hydroxyacetophenone
The XLogP value of 3.0107 indicates that 3'-Bromo-5'-chloro-2'-hydroxyacetophenone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 3'-Bromo-5'-chloro-2'-hydroxyacetophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3'-Bromo-5'-chloro-2'-hydroxyacetophenone has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3'-Bromo-5'-chloro-2'-hydroxyacetophenone?
The CAS number of 3'-Bromo-5'-chloro-2'-hydroxyacetophenone is 59443-15-1.
What is the molecular formula of 3'-Bromo-5'-chloro-2'-hydroxyacetophenone?
The molecular formula of 3'-Bromo-5'-chloro-2'-hydroxyacetophenone is C8H6BrClO2.
What is the molecular weight of 3'-Bromo-5'-chloro-2'-hydroxyacetophenone?
The molecular weight of 3'-Bromo-5'-chloro-2'-hydroxyacetophenone is 247.92 g/mol.
Where can I buy 3'-Bromo-5'-chloro-2'-hydroxyacetophenone?
You can request a quote for 3'-Bromo-5'-chloro-2'-hydroxyacetophenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3'-Bromo-5'-chloro-2'-hydroxyacetophenone?
Yes, KEHONG BIO provides custom synthesis services for 3'-Bromo-5'-chloro-2'-hydroxyacetophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.