4,5-Dibromo-2-fluorobenzoic acid
TL;DR: 4,5-Dibromo-2-fluorobenzoic acid (CAS 289039-48-1) is a chemical compound with molecular formula C7H3Br2FO2 and molecular weight 295.85 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dibromo-2-fluorobenzoic acid
Also Known As: 4,5-dibromo-2-fluorobenzoic acid, Apalutamide Impurity 147, Benzoic acid, 4,5-dibromo-2-fluoro-, 4,5-dibromo-2-fluoro-benzoic Acid, 45-Dibromo-2-fluorobenzoic acid
| Molecular Formula | C7H3Br2FO2 |
|---|---|
| Molecular Weight | 295.85 g/mol |
| LogP | 3.0489 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 295.8484 |
| Heavy Atoms | 12 |
| Complexity | 338.4234 |
Chemical Identifiers
| CAS Number | 289039-48-1 |
|---|---|
| SMILES | C1=C(C(=CC(=C1Br)Br)F)C(=O)O |
Product Overview
4,5-Dibromo-2-fluorobenzoic acid (CAS 289039-48-1), with molecular formula C7H3Br2FO2 and molecular weight 295.85 g/mol. IUPAC: 4,5-dibromo-2-fluorobenzoic acid.
Chemical Property Profile of 4,5-Dibromo-2-fluorobenzoic acid
Property Insights of 4,5-Dibromo-2-fluorobenzoic acid
The XLogP value of 3.0489 indicates that 4,5-Dibromo-2-fluorobenzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 4,5-Dibromo-2-fluorobenzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5-Dibromo-2-fluorobenzoic acid has 1 hydrogen bond donor(s) and 1 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 4,5-Dibromo-2-fluorobenzoic acid?
The CAS number of 4,5-Dibromo-2-fluorobenzoic acid is 289039-48-1.
What is the molecular formula of 4,5-Dibromo-2-fluorobenzoic acid?
The molecular formula of 4,5-Dibromo-2-fluorobenzoic acid is C7H3Br2FO2.
What is the molecular weight of 4,5-Dibromo-2-fluorobenzoic acid?
The molecular weight of 4,5-Dibromo-2-fluorobenzoic acid is 295.85 g/mol.
Where can I buy 4,5-Dibromo-2-fluorobenzoic acid?
You can request a quote for 4,5-Dibromo-2-fluorobenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5-Dibromo-2-fluorobenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4,5-Dibromo-2-fluorobenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.