![2-[2-(5-Chloro-2-thienyl)ethyl]benzoic acid structure](/static/products/7416/74168-71-1.webp)
2-[2-(5-Chloro-2-thienyl)ethyl]benzoic acid
TL;DR: 2-[2-(5-Chloro-2-thienyl)ethyl]benzoic acid (CAS 74168-71-1) is a chemical compound with molecular formula C13H11ClO2S and molecular weight 266.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(5-chlorothiophen-2-yl)ethyl]benzoic acid
Also Known As: 2-[2-(5-chloro-2-thienyl)ethyl]benzoic acid, 2-[2-(5-chlorothiophen-2-yl)ethyl]benzoic acid, AI-942/13331826, 2-(2-(5-Chlorothiophen-2-yl)ethyl)benzoic acid
| Molecular Formula | C13H11ClO2S |
|---|---|
| Molecular Weight | 266.02 g/mol |
| LogP | 3.8849 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 266.0168 |
| Heavy Atoms | 17 |
| Complexity | 533.72064 |
Chemical Identifiers
| CAS Number | 74168-71-1 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CCC2=CC=C(S2)Cl)C(=O)O |
Product Overview
2-[2-(5-Chloro-2-thienyl)ethyl]benzoic acid (CAS 74168-71-1), with molecular formula C13H11ClO2S and molecular weight 266.02 g/mol. IUPAC: 2-[2-(5-chlorothiophen-2-yl)ethyl]benzoic acid.
Chemical Property Profile of 2-[2-(5-Chloro-2-thienyl)ethyl]benzoic acid
Property Insights of 2-[2-(5-Chloro-2-thienyl)ethyl]benzoic acid
The XLogP value of 3.8849 indicates that 2-[2-(5-Chloro-2-thienyl)ethyl]benzoic 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, 2-[2-(5-Chloro-2-thienyl)ethyl]benzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[2-(5-Chloro-2-thienyl)ethyl]benzoic 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 2-[2-(5-Chloro-2-thienyl)ethyl]benzoic acid?
The CAS number of 2-[2-(5-Chloro-2-thienyl)ethyl]benzoic acid is 74168-71-1.
What is the molecular formula of 2-[2-(5-Chloro-2-thienyl)ethyl]benzoic acid?
The molecular formula of 2-[2-(5-Chloro-2-thienyl)ethyl]benzoic acid is C13H11ClO2S.
What is the molecular weight of 2-[2-(5-Chloro-2-thienyl)ethyl]benzoic acid?
The molecular weight of 2-[2-(5-Chloro-2-thienyl)ethyl]benzoic acid is 266.02 g/mol.
Where can I buy 2-[2-(5-Chloro-2-thienyl)ethyl]benzoic acid?
You can request a quote for 2-[2-(5-Chloro-2-thienyl)ethyl]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[2-(5-Chloro-2-thienyl)ethyl]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[2-(5-Chloro-2-thienyl)ethyl]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.