6-Fluoro-1-benzothiophene-2-carboxylic acid
TL;DR: 6-Fluoro-1-benzothiophene-2-carboxylic acid (CAS 142329-23-5) is a chemical compound with molecular formula C9H5FO2S and molecular weight 195.99944 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-fluoro-1-benzothiophene-2-carboxylic acid
Also Known As: 6-fluorobenzo[b]thiophene-2-carboxylic acid, 6-fluoro-1-benzothiophene-2-carboxylic acid, 6-Fluoro-benzo[b]thiophene-2-carboxylic acid, Benzo[b]thiophene-2-carboxylic acid, 6-fluoro-, 6-Fluorobenzothiophene-2-carboxylic acid
Technical Specifications
| Molecular Formula | C9H5FO2S |
| Molecular Weight | 195.99944 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 65.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 195.99944 Da |
| Heavy Atoms | 13 |
| Complexity | 222.0 |
| SMILES | C1=CC2=C(C=C1F)SC(=C2)C(=O)O |
| InChIKey | KAIFCLLXRYSWNU-UHFFFAOYSA-N |
Chemical Property Profile of 6-Fluoro-1-benzothiophene-2-carboxylic acid
Property Insights of 6-Fluoro-1-benzothiophene-2-carboxylic acid
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Fluoro-1-benzothiophene-2-carboxylic acid. The TPSA of 65.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Fluoro-1-benzothiophene-2-carboxylic acid. Following Lipinski's Rule of Five, 6-Fluoro-1-benzothiophene-2-carboxylic acid has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 6-Fluoro-1-benzothiophene-2-carboxylic acid?
The CAS number of 6-Fluoro-1-benzothiophene-2-carboxylic acid is 142329-23-5.
What is the molecular formula of 6-Fluoro-1-benzothiophene-2-carboxylic acid?
The molecular formula of 6-Fluoro-1-benzothiophene-2-carboxylic acid is C9H5FO2S.
What is the molecular weight of 6-Fluoro-1-benzothiophene-2-carboxylic acid?
The molecular weight of 6-Fluoro-1-benzothiophene-2-carboxylic acid is 195.99944 g/mol.
Where can I buy 6-Fluoro-1-benzothiophene-2-carboxylic acid?
You can request a quote for 6-Fluoro-1-benzothiophene-2-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 6-Fluoro-1-benzothiophene-2-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for 6-Fluoro-1-benzothiophene-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.