![3-Benzo[b]thiophen-2-ylbenzoic acid structure](/static/products/1023/1023489-08-8.webp)
3-Benzo[b]thiophen-2-ylbenzoic acid
TL;DR: 3-Benzo[b]thiophen-2-ylbenzoic acid (CAS 1023489-08-8) is a chemical compound with molecular formula C15H10O2S and molecular weight 254.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1-benzothiophen-2-yl)benzoic acid
Also Known As: 3-benzo[b]thiophen-2-ylbenzoic acid, 3-(1-benzothiophen-2-yl)benzoic acid, 3-(1-Benzothien-2-yl)benzoic acid, 3-benzothiophen-2-ylbenzoic Acid, 3-(benzothiophen-2-yl)benzoic acid
| Molecular Formula | C15H10O2S |
|---|---|
| Molecular Weight | 254.04 g/mol |
| LogP | 4.2665 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 254.04015 |
| Heavy Atoms | 18 |
| Complexity | 694.9466 |
Chemical Identifiers
| CAS Number | 1023489-08-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(S2)C3=CC(=CC=C3)C(=O)O |
Product Overview
3-Benzo[b]thiophen-2-ylbenzoic acid (CAS 1023489-08-8), with molecular formula C15H10O2S and molecular weight 254.04 g/mol. IUPAC: 3-(1-benzothiophen-2-yl)benzoic acid.
Chemical Property Profile of 3-Benzo[b]thiophen-2-ylbenzoic acid
Property Insights of 3-Benzo[b]thiophen-2-ylbenzoic acid
The XLogP value of 4.2665 indicates that 3-Benzo[b]thiophen-2-ylbenzoic 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, 3-Benzo[b]thiophen-2-ylbenzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Benzo[b]thiophen-2-ylbenzoic 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 3-Benzo[b]thiophen-2-ylbenzoic acid?
The CAS number of 3-Benzo[b]thiophen-2-ylbenzoic acid is 1023489-08-8.
What is the molecular formula of 3-Benzo[b]thiophen-2-ylbenzoic acid?
The molecular formula of 3-Benzo[b]thiophen-2-ylbenzoic acid is C15H10O2S.
What is the molecular weight of 3-Benzo[b]thiophen-2-ylbenzoic acid?
The molecular weight of 3-Benzo[b]thiophen-2-ylbenzoic acid is 254.04 g/mol.
Where can I buy 3-Benzo[b]thiophen-2-ylbenzoic acid?
You can request a quote for 3-Benzo[b]thiophen-2-ylbenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Benzo[b]thiophen-2-ylbenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Benzo[b]thiophen-2-ylbenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.