![[3-(Ethylthio)phenyl]boronic acid structure](/static/products/1626/162607-16-1.webp)
[3-(Ethylthio)phenyl]boronic acid
TL;DR: [3-(Ethylthio)phenyl]boronic acid (CAS 162607-16-1) is a chemical compound with molecular formula C8H11BO2S and molecular weight 182.05728 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3-ethylsulfanylphenyl)boronic acid
Also Known As: 3-Ethylthiophenylboronic acid, 3-(Ethylthio)phenylboronic acid, (3-(Ethylthio)phenyl)boronic acid, (3-ethylsulfanylphenyl)boronic Acid, 5-ETHYLTHIOPHENYLBORONIC ACID
Technical Specifications
| Molecular Formula | C8H11BO2S |
| Molecular Weight | 182.05728 g/mol |
| XLogP | 0.4784 |
| Topological Polar Surface Area (TPSA) | 65.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 182.05728 Da |
| Heavy Atoms | 12 |
| Complexity | 132.0 |
| SMILES | B(C1=CC(=CC=C1)SCC)(O)O |
| InChIKey | CZODYJDCHKOBID-UHFFFAOYSA-N |
Chemical Property Profile of [3-(Ethylthio)phenyl]boronic acid
Property Insights of [3-(Ethylthio)phenyl]boronic acid
The XLogP value of 0.4784 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [3-(Ethylthio)phenyl]boronic acid. The TPSA of 65.8 Ų falls within the moderate polarity range, balancing permeability and solubility for [3-(Ethylthio)phenyl]boronic acid. Following Lipinski's Rule of Five, [3-(Ethylthio)phenyl]boronic acid has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of [3-(Ethylthio)phenyl]boronic acid?
The CAS number of [3-(Ethylthio)phenyl]boronic acid is 162607-16-1.
What is the molecular formula of [3-(Ethylthio)phenyl]boronic acid?
The molecular formula of [3-(Ethylthio)phenyl]boronic acid is C8H11BO2S.
What is the molecular weight of [3-(Ethylthio)phenyl]boronic acid?
The molecular weight of [3-(Ethylthio)phenyl]boronic acid is 182.05728 g/mol.
Where can I buy [3-(Ethylthio)phenyl]boronic acid?
You can request a quote for [3-(Ethylthio)phenyl]boronic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for [3-(Ethylthio)phenyl]boronic acid?
Yes, CoreyChem provides custom synthesis services for [3-(Ethylthio)phenyl]boronic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.