4,6-Diaminobenzene-1,3-dicarboxylic acid
TL;DR: 4,6-Diaminobenzene-1,3-dicarboxylic acid (CAS 13324-94-2) is a chemical compound with molecular formula C8H8N2O4 and molecular weight 196.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-diaminobenzene-1,3-dicarboxylic acid
Also Known As: 4,6-diaminobenzene-1,3-dicarboxylic acid, 4,6-diaminoisophthalic acid, 4,6-diamino-1,3-benzenedicarboxylic acid, ZERO/004966, 1,3-Benzenedicarboxylic acid, 4,6-diamino-
| Molecular Formula | C8H8N2O4 |
|---|---|
| Molecular Weight | 196.05 g/mol |
| LogP | 0.2474 |
| Topological Polar Surface Area | 126.64 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 196.0484 |
| Heavy Atoms | 14 |
| Complexity | 378.79745 |
Chemical Identifiers
| CAS Number | 13324-94-2 |
|---|---|
| SMILES | C1=C(C(=CC(=C1C(=O)O)N)N)C(=O)O |
Product Overview
4,6-Diaminobenzene-1,3-dicarboxylic acid (CAS 13324-94-2), with molecular formula C8H8N2O4 and molecular weight 196.05 g/mol. IUPAC: 4,6-diaminobenzene-1,3-dicarboxylic acid.
Chemical Property Profile of 4,6-Diaminobenzene-1,3-dicarboxylic acid
Property Insights of 4,6-Diaminobenzene-1,3-dicarboxylic acid
The XLogP value of 0.2474 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,6-Diaminobenzene-1,3-dicarboxylic acid. The TPSA of 126.64 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,6-Diaminobenzene-1,3-dicarboxylic acid. Following Lipinski's Rule of Five, 4,6-Diaminobenzene-1,3-dicarboxylic 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 4,6-Diaminobenzene-1,3-dicarboxylic acid?
The CAS number of 4,6-Diaminobenzene-1,3-dicarboxylic acid is 13324-94-2.
What is the molecular formula of 4,6-Diaminobenzene-1,3-dicarboxylic acid?
The molecular formula of 4,6-Diaminobenzene-1,3-dicarboxylic acid is C8H8N2O4.
What is the molecular weight of 4,6-Diaminobenzene-1,3-dicarboxylic acid?
The molecular weight of 4,6-Diaminobenzene-1,3-dicarboxylic acid is 196.05 g/mol.
Where can I buy 4,6-Diaminobenzene-1,3-dicarboxylic acid?
You can request a quote for 4,6-Diaminobenzene-1,3-dicarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-Diaminobenzene-1,3-dicarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4,6-Diaminobenzene-1,3-dicarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.