3-Bromo-5-chloro-2-hydroxybenzoic acid
TL;DR: 3-Bromo-5-chloro-2-hydroxybenzoic acid (CAS 4068-58-0) is a chemical compound with molecular formula C7H4BrClO3 and molecular weight 249.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-5-chloro-2-hydroxybenzoic acid
Also Known As: 3-bromo-5-chloro-2-hydroxybenzoic acid, 3-bromo-5-chlorosalicylic acid, 3-BROMO-5-CHLORO SALICYLIC ACID, 3-Bromo-5-chlorosalicylicacid, Benzoic acid, 3-bromo-5-chloro-2-hydroxy-
| Molecular Formula | C7H4BrClO3 |
|---|---|
| Molecular Weight | 249.90 g/mol |
| LogP | 2.5063 |
| Topological Polar Surface Area | 57.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 249.90323 |
| Heavy Atoms | 12 |
| Complexity | 337.66852 |
Chemical Identifiers
| CAS Number | 4068-58-0 |
|---|---|
| SMILES | C1=C(C=C(C(=C1C(=O)O)O)Br)Cl |
Product Overview
3-Bromo-5-chloro-2-hydroxybenzoic acid (CAS 4068-58-0), with molecular formula C7H4BrClO3 and molecular weight 249.90 g/mol. IUPAC: 3-bromo-5-chloro-2-hydroxybenzoic acid.
Chemical Property Profile of 3-Bromo-5-chloro-2-hydroxybenzoic acid
Property Insights of 3-Bromo-5-chloro-2-hydroxybenzoic acid
The XLogP value of 2.5063 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Bromo-5-chloro-2-hydroxybenzoic acid. With a topological polar surface area (TPSA) of 57.53 Ų, 3-Bromo-5-chloro-2-hydroxybenzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Bromo-5-chloro-2-hydroxybenzoic acid has 2 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-hydroxybenzoic acid?
The CAS number of 3-Bromo-5-chloro-2-hydroxybenzoic acid is 4068-58-0.
What is the molecular formula of 3-Bromo-5-chloro-2-hydroxybenzoic acid?
The molecular formula of 3-Bromo-5-chloro-2-hydroxybenzoic acid is C7H4BrClO3.
What is the molecular weight of 3-Bromo-5-chloro-2-hydroxybenzoic acid?
The molecular weight of 3-Bromo-5-chloro-2-hydroxybenzoic acid is 249.90 g/mol.
Where can I buy 3-Bromo-5-chloro-2-hydroxybenzoic acid?
You can request a quote for 3-Bromo-5-chloro-2-hydroxybenzoic acid 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-hydroxybenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Bromo-5-chloro-2-hydroxybenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.