Boronic acid, phenyl-, dimethyl ester
TL;DR: Boronic acid, phenyl-, dimethyl ester (CAS 13471-35-7) is a chemical compound with molecular formula C8H11BO2 and molecular weight 150.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethoxy(phenyl)borane
Also Known As: dimethyl phenylboronate, dimethoxy(phenyl)borane, Boronic acid,phenyl-dimethyl ester, dimethoxyphenylborane, Boronic acid, phenyl-, dimethyl ester
| Molecular Formula | C8H11BO2 |
|---|---|
| Molecular Weight | 150.09 g/mol |
| LogP | 0.6746 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 150.0852 |
| Heavy Atoms | 11 |
| Complexity | 98.0 |
Chemical Identifiers
| CAS Number | 13471-35-7 |
|---|---|
| SMILES | B(C1=CC=CC=C1)(OC)OC |
| InChIKey | MJMJJGCCNUPJBI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Boronic acid, phenyl-, dimethyl ester (CAS 13471-35-7), with molecular formula C8H11BO2 and molecular weight 150.09 g/mol. IUPAC: dimethoxy(phenyl)borane.
Chemical Property Profile of Boronic acid, phenyl-, dimethyl ester
Property Insights of Boronic acid, phenyl-, dimethyl ester
The XLogP value of 0.6746 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Boronic acid, phenyl-, dimethyl ester. With a topological polar surface area (TPSA) of 18.5 Ų, Boronic acid, phenyl-, dimethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Boronic acid, phenyl-, dimethyl ester has 0 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 Boronic acid, phenyl-, dimethyl ester?
The CAS number of Boronic acid, phenyl-, dimethyl ester is 13471-35-7.
What is the molecular formula of Boronic acid, phenyl-, dimethyl ester?
The molecular formula of Boronic acid, phenyl-, dimethyl ester is C8H11BO2.
What is the molecular weight of Boronic acid, phenyl-, dimethyl ester?
The molecular weight of Boronic acid, phenyl-, dimethyl ester is 150.09 g/mol.
Where can I buy Boronic acid, phenyl-, dimethyl ester?
You can request a quote for Boronic acid, phenyl-, dimethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Boronic acid, phenyl-, dimethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Boronic acid, phenyl-, dimethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.