4-Bromophthalic anhydride
TL;DR: 4-Bromophthalic anhydride (CAS 86-90-8) is a chemical compound with molecular formula C8H3BrO3 and molecular weight 225.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-2-benzofuran-1,3-dione
Also Known As: 4-Bromophthalic anhydride, 5-bromoisobenzofuran-1,3-dione, 5-Bromo-2-benzofuran-1,3-dione, 4-Bromophthalicanhydride, 4-Bromo Phthalic anhydride
| Molecular Formula | C8H3BrO3 |
|---|---|
| Molecular Weight | 225.93 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 225.92656 |
| Heavy Atoms | 12 |
| Complexity | 238.0 |
Chemical Identifiers
| CAS Number | 86-90-8 |
|---|---|
| SMILES | C1=CC2=C(C=C1Br)C(=O)OC2=O |
| InChIKey | BCKVHOUUJMYIAN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Bromophthalic anhydride (CAS 86-90-8), with molecular formula C8H3BrO3 and molecular weight 225.93 g/mol. IUPAC: 5-bromo-2-benzofuran-1,3-dione.
Chemical Property Profile of 4-Bromophthalic anhydride
Property Insights of 4-Bromophthalic anhydride
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Bromophthalic anhydride. With a topological polar surface area (TPSA) of 43.4 Ų, 4-Bromophthalic anhydride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromophthalic anhydride has 0 hydrogen bond donor(s) and 3 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-Bromophthalic anhydride?
The CAS number of 4-Bromophthalic anhydride is 86-90-8.
What is the molecular formula of 4-Bromophthalic anhydride?
The molecular formula of 4-Bromophthalic anhydride is C8H3BrO3.
What is the molecular weight of 4-Bromophthalic anhydride?
The molecular weight of 4-Bromophthalic anhydride is 225.93 g/mol.
Where can I buy 4-Bromophthalic anhydride?
You can request a quote for 4-Bromophthalic anhydride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromophthalic anhydride?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromophthalic anhydride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.