4-Chlorothiophene-2-boronic acid
TL;DR: 4-Chlorothiophene-2-boronic acid (CAS 1133931-02-8) is a chemical compound with molecular formula C4H4BClO2S and molecular weight 161.97136 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-chlorothiophen-2-yl)boronic acid
Also Known As: 4-CHLOROTHIOPHENE-2-BORONIC ACID, (4-chlorothiophen-2-yl)boronic Acid, Boronic acid, B-(4-chloro-2-thienyl)-, (4-chloro-2-thienyl)boronic acid, 4-CHLOROTHIOPHEN-2-YLBORONIC ACID
Technical Specifications
| Molecular Formula | C4H4BClO2S |
| Molecular Weight | 161.97136 g/mol |
| XLogP | 0.0813 |
| Topological Polar Surface Area (TPSA) | 68.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 161.97136 Da |
| Heavy Atoms | 9 |
| Complexity | 103.0 |
| SMILES | B(C1=CC(=CS1)Cl)(O)O |
| InChIKey | YMNZWJFZOOKLRS-UHFFFAOYSA-N |
Chemical Property Profile of 4-Chlorothiophene-2-boronic acid
Property Insights of 4-Chlorothiophene-2-boronic acid
The XLogP value of 0.0813 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chlorothiophene-2-boronic acid. The TPSA of 68.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Chlorothiophene-2-boronic acid. Following Lipinski's Rule of Five, 4-Chlorothiophene-2-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 4-Chlorothiophene-2-boronic acid?
The CAS number of 4-Chlorothiophene-2-boronic acid is 1133931-02-8.
What is the molecular formula of 4-Chlorothiophene-2-boronic acid?
The molecular formula of 4-Chlorothiophene-2-boronic acid is C4H4BClO2S.
What is the molecular weight of 4-Chlorothiophene-2-boronic acid?
The molecular weight of 4-Chlorothiophene-2-boronic acid is 161.97136 g/mol.
Where can I buy 4-Chlorothiophene-2-boronic acid?
You can request a quote for 4-Chlorothiophene-2-boronic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Chlorothiophene-2-boronic acid?
Yes, CoreyChem provides custom synthesis services for 4-Chlorothiophene-2-boronic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.