![3,3',6,6'-Tetramethyl[1,1'-biphenyl]-2,2'-dicarboxylic acid structure](/static/products/1554/15540-80-4.webp)
3,3',6,6'-Tetramethyl[1,1'-biphenyl]-2,2'-dicarboxylic acid
TL;DR: 3,3',6,6'-Tetramethyl[1,1'-biphenyl]-2,2'-dicarboxylic acid (CAS 15540-80-4) is a chemical compound with molecular formula C18H18O4 and molecular weight 298.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-carboxy-3,6-dimethylphenyl)-3,6-dimethylbenzoic acid
Also Known As: 3,3',6,6'-tetramethyl[1,1'-biphenyl]-2,2'-dicarboxylic acid, 2,2 -Bi(3,6-dimethylbenzoic acid), AI-942/13332134, J1.869.069A, AI-942/13332135
| Molecular Formula | C18H18O4 |
|---|---|
| Molecular Weight | 298.12 g/mol |
| LogP | 3.98368 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 298.1205 |
| Heavy Atoms | 22 |
| Complexity | 720.65955 |
Chemical Identifiers
| CAS Number | 15540-80-4 |
|---|---|
| SMILES | CC1=C(C(=C(C=C1)C)C(=O)O)C2=C(C=CC(=C2C(=O)O)C)C |
Product Overview
3,3',6,6'-Tetramethyl[1,1'-biphenyl]-2,2'-dicarboxylic acid (CAS 15540-80-4), with molecular formula C18H18O4 and molecular weight 298.12 g/mol. IUPAC: 2-(2-carboxy-3,6-dimethylphenyl)-3,6-dimethylbenzoic acid.
Chemical Property Profile of 3,3',6,6'-Tetramethyl[1,1'-biphenyl]-2,2'-dicarboxylic acid
Property Insights of 3,3',6,6'-Tetramethyl[1,1'-biphenyl]-2,2'-dicarboxylic acid
The XLogP value of 3.98368 indicates that 3,3',6,6'-Tetramethyl[1,1'-biphenyl]-2,2'-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 3,3',6,6'-Tetramethyl[1,1'-biphenyl]-2,2'-dicarboxylic acid. Following Lipinski's Rule of Five, 3,3',6,6'-Tetramethyl[1,1'-biphenyl]-2,2'-dicarboxylic acid has 2 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 3,3',6,6'-Tetramethyl[1,1'-biphenyl]-2,2'-dicarboxylic acid?
The CAS number of 3,3',6,6'-Tetramethyl[1,1'-biphenyl]-2,2'-dicarboxylic acid is 15540-80-4.
What is the molecular formula of 3,3',6,6'-Tetramethyl[1,1'-biphenyl]-2,2'-dicarboxylic acid?
The molecular formula of 3,3',6,6'-Tetramethyl[1,1'-biphenyl]-2,2'-dicarboxylic acid is C18H18O4.
What is the molecular weight of 3,3',6,6'-Tetramethyl[1,1'-biphenyl]-2,2'-dicarboxylic acid?
The molecular weight of 3,3',6,6'-Tetramethyl[1,1'-biphenyl]-2,2'-dicarboxylic acid is 298.12 g/mol.
Where can I buy 3,3',6,6'-Tetramethyl[1,1'-biphenyl]-2,2'-dicarboxylic acid?
You can request a quote for 3,3',6,6'-Tetramethyl[1,1'-biphenyl]-2,2'-dicarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3',6,6'-Tetramethyl[1,1'-biphenyl]-2,2'-dicarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3,3',6,6'-Tetramethyl[1,1'-biphenyl]-2,2'-dicarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.