(3,5-Difluoro-2-(methoxycarbonyl)phenyl)boronic acid
TL;DR: (3,5-Difluoro-2-(methoxycarbonyl)phenyl)boronic acid (CAS 2096338-97-3) is a chemical compound with molecular formula C8H7BF2O4 and molecular weight 216.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,5-difluoro-2-methoxycarbonylphenyl)boronic acid
Also Known As: (3,5-difluoro-2-methoxycarbonyl-phenyl)boronic Acid, (3,5-difluoro-2-methoxycarbonylphenyl)boronic acid, (3,5-Difluoro-2-(methoxycarbonyl)phenyl)boronic acid
| Molecular Formula | C8H7BF2O4 |
|---|---|
| Molecular Weight | 216.04 g/mol |
| LogP | -0.5688 |
| Topological Polar Surface Area | 66.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 216.04054 |
| Heavy Atoms | 15 |
| Complexity | 394.4732 |
Chemical Identifiers
| CAS Number | 2096338-97-3 |
|---|---|
| SMILES | B(C1=CC(=CC(=C1C(=O)OC)F)F)(O)O |
Product Overview
(3,5-Difluoro-2-(methoxycarbonyl)phenyl)boronic acid (CAS 2096338-97-3), with molecular formula C8H7BF2O4 and molecular weight 216.04 g/mol. IUPAC: (3,5-difluoro-2-methoxycarbonylphenyl)boronic acid.
Chemical Property Profile of (3,5-Difluoro-2-(methoxycarbonyl)phenyl)boronic acid
Property Insights of (3,5-Difluoro-2-(methoxycarbonyl)phenyl)boronic acid
The XLogP value of -0.5688 indicates that (3,5-Difluoro-2-(methoxycarbonyl)phenyl)boronic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 66.76 Ų falls within the moderate polarity range, balancing permeability and solubility for (3,5-Difluoro-2-(methoxycarbonyl)phenyl)boronic acid. Following Lipinski's Rule of Five, (3,5-Difluoro-2-(methoxycarbonyl)phenyl)boronic acid has 2 hydrogen bond donor(s) and 4 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 (3,5-Difluoro-2-(methoxycarbonyl)phenyl)boronic acid?
The CAS number of (3,5-Difluoro-2-(methoxycarbonyl)phenyl)boronic acid is 2096338-97-3.
What is the molecular formula of (3,5-Difluoro-2-(methoxycarbonyl)phenyl)boronic acid?
The molecular formula of (3,5-Difluoro-2-(methoxycarbonyl)phenyl)boronic acid is C8H7BF2O4.
What is the molecular weight of (3,5-Difluoro-2-(methoxycarbonyl)phenyl)boronic acid?
The molecular weight of (3,5-Difluoro-2-(methoxycarbonyl)phenyl)boronic acid is 216.04 g/mol.
Where can I buy (3,5-Difluoro-2-(methoxycarbonyl)phenyl)boronic acid?
You can request a quote for (3,5-Difluoro-2-(methoxycarbonyl)phenyl)boronic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3,5-Difluoro-2-(methoxycarbonyl)phenyl)boronic acid?
Yes, KEHONG BIO provides custom synthesis services for (3,5-Difluoro-2-(methoxycarbonyl)phenyl)boronic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.