4,5-Dibromobenzene-1,3-dicarboxylic acid
TL;DR: 4,5-Dibromobenzene-1,3-dicarboxylic acid (CAS 379711-34-9) is a chemical compound with molecular formula C8H4Br2O4 and molecular weight 321.85 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dibromobenzene-1,3-dicarboxylic acid
Also Known As: 4,5-dibromoisophthalic acid, 4,5-dibromobenzene-1,3-dicarboxylic Acid
| Molecular Formula | C8H4Br2O4 |
|---|---|
| Molecular Weight | 321.85 g/mol |
| LogP | 2.608 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 321.84763 |
| Heavy Atoms | 14 |
| Complexity | 414.04745 |
Chemical Identifiers
| CAS Number | 379711-34-9 |
|---|---|
| SMILES | C1=C(C=C(C(=C1C(=O)O)Br)Br)C(=O)O |
Product Overview
4,5-Dibromobenzene-1,3-dicarboxylic acid (CAS 379711-34-9), with molecular formula C8H4Br2O4 and molecular weight 321.85 g/mol. IUPAC: 4,5-dibromobenzene-1,3-dicarboxylic acid.
Chemical Property Profile of 4,5-Dibromobenzene-1,3-dicarboxylic acid
Property Insights of 4,5-Dibromobenzene-1,3-dicarboxylic acid
The XLogP value of 2.608 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,5-Dibromobenzene-1,3-dicarboxylic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,5-Dibromobenzene-1,3-dicarboxylic acid. Following Lipinski's Rule of Five, 4,5-Dibromobenzene-1,3-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 4,5-Dibromobenzene-1,3-dicarboxylic acid?
The CAS number of 4,5-Dibromobenzene-1,3-dicarboxylic acid is 379711-34-9.
What is the molecular formula of 4,5-Dibromobenzene-1,3-dicarboxylic acid?
The molecular formula of 4,5-Dibromobenzene-1,3-dicarboxylic acid is C8H4Br2O4.
What is the molecular weight of 4,5-Dibromobenzene-1,3-dicarboxylic acid?
The molecular weight of 4,5-Dibromobenzene-1,3-dicarboxylic acid is 321.85 g/mol.
Where can I buy 4,5-Dibromobenzene-1,3-dicarboxylic acid?
You can request a quote for 4,5-Dibromobenzene-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 4,5-Dibromobenzene-1,3-dicarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4,5-Dibromobenzene-1,3-dicarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.