2,6-Difluoro-3-hydroxybenzoic acid
TL;DR: 2,6-Difluoro-3-hydroxybenzoic acid (CAS 749230-32-8) is a chemical compound with molecular formula C7H4F2O3 and molecular weight 174.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-difluoro-3-hydroxybenzoic acid
Also Known As: 2,6-Difluoro-3-hydroxybenzoic acid, 2,6 Difluoro 3-hydroxy benzoic acid, Benzoic acid, 2,6-difluoro-3-hydroxy-, 3-Carboxy-2,4-difluorophenol, 2,6Difluoro3-hydroxybenzoicacid
| Molecular Formula | C7H4F2O3 |
|---|---|
| Molecular Weight | 174.01 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 174.01285 |
| Heavy Atoms | 12 |
| Complexity | 185.0 |
Chemical Identifiers
| CAS Number | 749230-32-8 |
|---|---|
| SMILES | C1=CC(=C(C(=C1O)F)C(=O)O)F |
| InChIKey | VWIWRPLTBLVKBV-UHFFFAOYSA-N |
Product Overview
2,6-Difluoro-3-hydroxybenzoic acid (CAS 749230-32-8), with molecular formula C7H4F2O3 and molecular weight 174.01 g/mol. IUPAC: 2,6-difluoro-3-hydroxybenzoic acid.
Chemical Property Profile of 2,6-Difluoro-3-hydroxybenzoic acid
Property Insights of 2,6-Difluoro-3-hydroxybenzoic acid
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-Difluoro-3-hydroxybenzoic acid. With a topological polar surface area (TPSA) of 57.5 Ų, 2,6-Difluoro-3-hydroxybenzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Difluoro-3-hydroxybenzoic acid has 2 hydrogen bond donor(s) and 5 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 2,6-Difluoro-3-hydroxybenzoic acid?
The CAS number of 2,6-Difluoro-3-hydroxybenzoic acid is 749230-32-8.
What is the molecular formula of 2,6-Difluoro-3-hydroxybenzoic acid?
The molecular formula of 2,6-Difluoro-3-hydroxybenzoic acid is C7H4F2O3.
What is the molecular weight of 2,6-Difluoro-3-hydroxybenzoic acid?
The molecular weight of 2,6-Difluoro-3-hydroxybenzoic acid is 174.01 g/mol.
Where can I buy 2,6-Difluoro-3-hydroxybenzoic acid?
You can request a quote for 2,6-Difluoro-3-hydroxybenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Difluoro-3-hydroxybenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Difluoro-3-hydroxybenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.