(6-Formyl-2H-1,3-benzodioxol-5-yl)boronic acid
TL;DR: (6-Formyl-2H-1,3-benzodioxol-5-yl)boronic acid (CAS 94838-88-7) is a chemical compound with molecular formula C8H7BO5 and molecular weight 194.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6-formyl-1,3-benzodioxol-5-yl)boronic acid
Also Known As: (6-Formylbenzo[d][1,3]dioxol-5-yl)boronic acid, 2-Formyl-4,5-methylenedioxyphenylboronic acid, (6-formyl-1,3-benzodioxol-5-yl)boronic acid, (2-Formyl-4,5-methylenedioxy)phenylboronic acid, (2-FORMYL-4,5-METHYLENEDIOXY)BENZENEBORONIC ACID
| Molecular Formula | C8H7BO5 |
|---|---|
| Molecular Weight | 194.04 g/mol |
| LogP | -1.0924 |
| Topological Polar Surface Area | 75.99 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 194.03865 |
| Heavy Atoms | 14 |
| Complexity | 376.23953 |
Chemical Identifiers
| CAS Number | 94838-88-7 |
|---|---|
| SMILES | B(C1=CC2=C(C=C1C=O)OCO2)(O)O |
Product Overview
(6-Formyl-2H-1,3-benzodioxol-5-yl)boronic acid (CAS 94838-88-7), with molecular formula C8H7BO5 and molecular weight 194.04 g/mol. IUPAC: (6-formyl-1,3-benzodioxol-5-yl)boronic acid.
Chemical Property Profile of (6-Formyl-2H-1,3-benzodioxol-5-yl)boronic acid
Property Insights of (6-Formyl-2H-1,3-benzodioxol-5-yl)boronic acid
The XLogP value of -1.0924 indicates that (6-Formyl-2H-1,3-benzodioxol-5-yl)boronic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 75.99 Ų falls within the moderate polarity range, balancing permeability and solubility for (6-Formyl-2H-1,3-benzodioxol-5-yl)boronic acid. Following Lipinski's Rule of Five, (6-Formyl-2H-1,3-benzodioxol-5-yl)boronic 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 (6-Formyl-2H-1,3-benzodioxol-5-yl)boronic acid?
The CAS number of (6-Formyl-2H-1,3-benzodioxol-5-yl)boronic acid is 94838-88-7.
What is the molecular formula of (6-Formyl-2H-1,3-benzodioxol-5-yl)boronic acid?
The molecular formula of (6-Formyl-2H-1,3-benzodioxol-5-yl)boronic acid is C8H7BO5.
What is the molecular weight of (6-Formyl-2H-1,3-benzodioxol-5-yl)boronic acid?
The molecular weight of (6-Formyl-2H-1,3-benzodioxol-5-yl)boronic acid is 194.04 g/mol.
Where can I buy (6-Formyl-2H-1,3-benzodioxol-5-yl)boronic acid?
You can request a quote for (6-Formyl-2H-1,3-benzodioxol-5-yl)boronic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (6-Formyl-2H-1,3-benzodioxol-5-yl)boronic acid?
Yes, KEHONG BIO provides custom synthesis services for (6-Formyl-2H-1,3-benzodioxol-5-yl)boronic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.