4-Bromophthalic acid
TL;DR: 4-Bromophthalic acid (CAS 6968-28-1) is a chemical compound with molecular formula C8H5BrO4 and molecular weight 243.93712 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-bromophthalic acid
Also Known As: 4-Bromophthalic acid, 4-bromophthalicacid, zlchem 539, 1,2-Benzenedicarboxylic acid, 4-bromo-, 5-bromo-phthalic acid
Application Areas
Top 5 of 10 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H5BrO4 |
| Molecular Weight | 243.93712 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 243.93712 Da |
| Heavy Atoms | 13 |
| Complexity | 228.0 |
| SMILES | C1=CC(=C(C=C1Br)C(=O)O)C(=O)O |
| InChIKey | AZXKGUVDIORSED-UHFFFAOYSA-N |
Chemical Property Profile of 4-Bromophthalic acid
Property Insights of 4-Bromophthalic acid
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Bromophthalic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Bromophthalic acid. Following Lipinski's Rule of Five, 4-Bromophthalic acid 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
What is the CAS number of 4-Bromophthalic acid?
The CAS number of 4-Bromophthalic acid is 6968-28-1.
What is the molecular formula of 4-Bromophthalic acid?
The molecular formula of 4-Bromophthalic acid is C8H5BrO4.
What is the molecular weight of 4-Bromophthalic acid?
The molecular weight of 4-Bromophthalic acid is 243.93712 g/mol.
Where can I buy 4-Bromophthalic acid?
You can request a quote for 4-Bromophthalic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Bromophthalic acid?
Yes, CoreyChem provides custom synthesis services for 4-Bromophthalic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.