![3-(2-Mercaptoethyl)-[1,1'-biphenyl]-2,3'-dicarboxylic acid structure](/static/products/378/378242-00-3.png)
3-(2-Mercaptoethyl)-[1,1'-biphenyl]-2,3'-dicarboxylic acid
TL;DR: 3-(2-Mercaptoethyl)-[1,1'-biphenyl]-2,3'-dicarboxylic acid (CAS 378242-00-3) is a chemical compound with molecular formula C16H14O4S and molecular weight 302.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-carboxyphenyl)-6-(2-sulfanylethyl)benzoic acid
Also Known As: 3-(2-Mercaptoethyl)biphenyl-2,3'-dicarboxylic acid, 2-(3-carboxyphenyl)-6-(2-sulfanylethyl)benzoic Acid, 3-(2-mercaptoethyl)-[1,1'-biphenyl]-2,3'-dicarboxylic acid
| Molecular Formula | C16H14O4S |
|---|---|
| Molecular Weight | 302.06 g/mol |
| LogP | 3.2223 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 302.06128 |
| Heavy Atoms | 21 |
| Complexity | 694.4264 |
Chemical Identifiers
| CAS Number | 378242-00-3 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(=O)O)C2=CC=CC(=C2C(=O)O)CCS |
Product Overview
3-(2-Mercaptoethyl)-[1,1'-biphenyl]-2,3'-dicarboxylic acid (CAS 378242-00-3), with molecular formula C16H14O4S and molecular weight 302.06 g/mol. IUPAC: 2-(3-carboxyphenyl)-6-(2-sulfanylethyl)benzoic acid.
Chemical Property Profile of 3-(2-Mercaptoethyl)-[1,1'-biphenyl]-2,3'-dicarboxylic acid
Property Insights of 3-(2-Mercaptoethyl)-[1,1'-biphenyl]-2,3'-dicarboxylic acid
The XLogP value of 3.2223 indicates that 3-(2-Mercaptoethyl)-[1,1'-biphenyl]-2,3'-dicarboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2-Mercaptoethyl)-[1,1'-biphenyl]-2,3'-dicarboxylic acid. Following Lipinski's Rule of Five, 3-(2-Mercaptoethyl)-[1,1'-biphenyl]-2,3'-dicarboxylic acid has 3 hydrogen bond donor(s) and 3 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-(2-Mercaptoethyl)-[1,1'-biphenyl]-2,3'-dicarboxylic acid?
The CAS number of 3-(2-Mercaptoethyl)-[1,1'-biphenyl]-2,3'-dicarboxylic acid is 378242-00-3.
What is the molecular formula of 3-(2-Mercaptoethyl)-[1,1'-biphenyl]-2,3'-dicarboxylic acid?
The molecular formula of 3-(2-Mercaptoethyl)-[1,1'-biphenyl]-2,3'-dicarboxylic acid is C16H14O4S.
What is the molecular weight of 3-(2-Mercaptoethyl)-[1,1'-biphenyl]-2,3'-dicarboxylic acid?
The molecular weight of 3-(2-Mercaptoethyl)-[1,1'-biphenyl]-2,3'-dicarboxylic acid is 302.06 g/mol.
Where can I buy 3-(2-Mercaptoethyl)-[1,1'-biphenyl]-2,3'-dicarboxylic acid?
You can request a quote for 3-(2-Mercaptoethyl)-[1,1'-biphenyl]-2,3'-dicarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Mercaptoethyl)-[1,1'-biphenyl]-2,3'-dicarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Mercaptoethyl)-[1,1'-biphenyl]-2,3'-dicarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.