4-Fluoro-3-methyl-1-benzothiophene-2-carboxylic acid
TL;DR: 4-Fluoro-3-methyl-1-benzothiophene-2-carboxylic acid (CAS 852940-49-9) is a chemical compound with molecular formula C10H7FO2S and molecular weight 210.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-fluoro-3-methyl-1-benzothiophene-2-carboxylic acid
Also Known As: 4-fluoro-3-methyl-1-benzothiophene-2-carboxylic acid, 4-Fluoro-3-methylbenzo[b]thiophene-2-carboxylic acid, 4-fluoro-3-methyl-benzothiophene-2-carboxylic Acid, 4-Fluoro-3-methylbenzo[b]thiophene-2-carboxylicacid, 4-Fluoro-3-methylbenzoBthiophene-2-carboxylic Acid
| Molecular Formula | C10H7FO2S |
|---|---|
| Molecular Weight | 210.02 g/mol |
| LogP | 3.04702 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 210.01508 |
| Heavy Atoms | 14 |
| Complexity | 516.0615 |
Chemical Identifiers
| CAS Number | 852940-49-9 |
|---|---|
| SMILES | CC1=C(SC2=CC=CC(=C12)F)C(=O)O |
Product Overview
4-Fluoro-3-methyl-1-benzothiophene-2-carboxylic acid (CAS 852940-49-9), with molecular formula C10H7FO2S and molecular weight 210.02 g/mol. IUPAC: 4-fluoro-3-methyl-1-benzothiophene-2-carboxylic acid.
Chemical Property Profile of 4-Fluoro-3-methyl-1-benzothiophene-2-carboxylic acid
Property Insights of 4-Fluoro-3-methyl-1-benzothiophene-2-carboxylic acid
The XLogP value of 3.04702 indicates that 4-Fluoro-3-methyl-1-benzothiophene-2-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 4-Fluoro-3-methyl-1-benzothiophene-2-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Fluoro-3-methyl-1-benzothiophene-2-carboxylic acid has 1 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 4-Fluoro-3-methyl-1-benzothiophene-2-carboxylic acid?
The CAS number of 4-Fluoro-3-methyl-1-benzothiophene-2-carboxylic acid is 852940-49-9.
What is the molecular formula of 4-Fluoro-3-methyl-1-benzothiophene-2-carboxylic acid?
The molecular formula of 4-Fluoro-3-methyl-1-benzothiophene-2-carboxylic acid is C10H7FO2S.
What is the molecular weight of 4-Fluoro-3-methyl-1-benzothiophene-2-carboxylic acid?
The molecular weight of 4-Fluoro-3-methyl-1-benzothiophene-2-carboxylic acid is 210.02 g/mol.
Where can I buy 4-Fluoro-3-methyl-1-benzothiophene-2-carboxylic acid?
You can request a quote for 4-Fluoro-3-methyl-1-benzothiophene-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Fluoro-3-methyl-1-benzothiophene-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Fluoro-3-methyl-1-benzothiophene-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.