Benzene-1,2-dicarboxylic acid, 3,5-dibromo-
TL;DR: Benzene-1,2-dicarboxylic acid, 3,5-dibromo- (CAS 114571-71-0) 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.
3,5-dibromophthalic acid
Also Known As: 3,5-Dibromophthalic acid, 3,5-dibromo-phthalic acid, 3,5-Dibromophthalic acid #, 3,5-dibromobenzene-1,2-dicarboxylic acid, Benzene-1,2-dicarboxylic acid, 3,5-dibromo-
| Molecular Formula | C8H4Br2O4 |
|---|---|
| Molecular Weight | 321.85 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 321.84763 |
| Heavy Atoms | 14 |
| Complexity | 256.0 |
Chemical Identifiers
| CAS Number | 114571-71-0 |
|---|---|
| SMILES | C1=C(C=C(C(=C1C(=O)O)C(=O)O)Br)Br |
| InChIKey | ZARQIGKXNOXWKA-UHFFFAOYSA-N |
Product Overview
Benzene-1,2-dicarboxylic acid, 3,5-dibromo- (CAS 114571-71-0), with molecular formula C8H4Br2O4 and molecular weight 321.85 g/mol. IUPAC: 3,5-dibromophthalic acid.
Chemical Property Profile of Benzene-1,2-dicarboxylic acid, 3,5-dibromo-
Property Insights of Benzene-1,2-dicarboxylic acid, 3,5-dibromo-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzene-1,2-dicarboxylic acid, 3,5-dibromo-. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzene-1,2-dicarboxylic acid, 3,5-dibromo-. Following Lipinski's Rule of Five, Benzene-1,2-dicarboxylic acid, 3,5-dibromo- has 2 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 Benzene-1,2-dicarboxylic acid, 3,5-dibromo-?
The CAS number of Benzene-1,2-dicarboxylic acid, 3,5-dibromo- is 114571-71-0.
What is the molecular formula of Benzene-1,2-dicarboxylic acid, 3,5-dibromo-?
The molecular formula of Benzene-1,2-dicarboxylic acid, 3,5-dibromo- is C8H4Br2O4.
What is the molecular weight of Benzene-1,2-dicarboxylic acid, 3,5-dibromo-?
The molecular weight of Benzene-1,2-dicarboxylic acid, 3,5-dibromo- is 321.85 g/mol.
Where can I buy Benzene-1,2-dicarboxylic acid, 3,5-dibromo-?
You can request a quote for Benzene-1,2-dicarboxylic acid, 3,5-dibromo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene-1,2-dicarboxylic acid, 3,5-dibromo-?
Yes, KEHONG BIO provides custom synthesis services for Benzene-1,2-dicarboxylic acid, 3,5-dibromo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.