2-(3-Carboxyanilino)terephthalic acid
TL;DR: 2-(3-Carboxyanilino)terephthalic acid (CAS 681459-65-4) is a chemical compound with molecular formula C15H11NO6 and molecular weight 301.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-carboxyanilino)terephthalic acid
Also Known As: 2-(3-carboxyanilino)terephthalic acid, 2-[(3-carboxyphenyl)amino]terephthalic Acid, 2-((3-carboxyphenyl)amino)terephthalic acid (en)1,4-Benzened
| Molecular Formula | C15H11NO6 |
|---|---|
| Molecular Weight | 301.06 g/mol |
| LogP | 2.5248 |
| Topological Polar Surface Area | 123.93 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 301.05862 |
| Heavy Atoms | 22 |
| Complexity | 768.37805 |
Chemical Identifiers
| CAS Number | 681459-65-4 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NC2=C(C=CC(=C2)C(=O)O)C(=O)O)C(=O)O |
Product Overview
2-(3-Carboxyanilino)terephthalic acid (CAS 681459-65-4), with molecular formula C15H11NO6 and molecular weight 301.06 g/mol. IUPAC: 2-(3-carboxyanilino)terephthalic acid.
Chemical Property Profile of 2-(3-Carboxyanilino)terephthalic acid
Property Insights of 2-(3-Carboxyanilino)terephthalic acid
The XLogP value of 2.5248 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-Carboxyanilino)terephthalic acid. The TPSA of 123.93 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-Carboxyanilino)terephthalic acid. Following Lipinski's Rule of Five, 2-(3-Carboxyanilino)terephthalic acid has 4 hydrogen bond donor(s) and 4 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-(3-Carboxyanilino)terephthalic acid?
The CAS number of 2-(3-Carboxyanilino)terephthalic acid is 681459-65-4.
What is the molecular formula of 2-(3-Carboxyanilino)terephthalic acid?
The molecular formula of 2-(3-Carboxyanilino)terephthalic acid is C15H11NO6.
What is the molecular weight of 2-(3-Carboxyanilino)terephthalic acid?
The molecular weight of 2-(3-Carboxyanilino)terephthalic acid is 301.06 g/mol.
Where can I buy 2-(3-Carboxyanilino)terephthalic acid?
You can request a quote for 2-(3-Carboxyanilino)terephthalic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-Carboxyanilino)terephthalic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Carboxyanilino)terephthalic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.