3-Bromo-2,5-furandione
TL;DR: 3-Bromo-2,5-furandione (CAS 5926-51-2) is a chemical compound with molecular formula C4HBrO3 and molecular weight 175.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromofuran-2,5-dione
Also Known As: Bromomaleic anhydride, 3-bromofuran-2,5-dione, 3-Bromo-2,5-furandione, Bromomaleicanhydride, C4HBrO3
| Molecular Formula | C4HBrO3 |
|---|---|
| Molecular Weight | 175.91 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 175.9109 |
| Heavy Atoms | 8 |
| Complexity | 182.0 |
Chemical Identifiers
| CAS Number | 5926-51-2 |
|---|---|
| SMILES | C1=C(C(=O)OC1=O)Br |
| InChIKey | YPRMWCKXOZFJGF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Bromo-2,5-furandione (CAS 5926-51-2), with molecular formula C4HBrO3 and molecular weight 175.91 g/mol. IUPAC: 3-bromofuran-2,5-dione.
Chemical Property Profile of 3-Bromo-2,5-furandione
Property Insights of 3-Bromo-2,5-furandione
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Bromo-2,5-furandione. With a topological polar surface area (TPSA) of 43.4 Ų, 3-Bromo-2,5-furandione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Bromo-2,5-furandione 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 3-Bromo-2,5-furandione?
The CAS number of 3-Bromo-2,5-furandione is 5926-51-2.
What is the molecular formula of 3-Bromo-2,5-furandione?
The molecular formula of 3-Bromo-2,5-furandione is C4HBrO3.
What is the molecular weight of 3-Bromo-2,5-furandione?
The molecular weight of 3-Bromo-2,5-furandione is 175.91 g/mol.
Where can I buy 3-Bromo-2,5-furandione?
You can request a quote for 3-Bromo-2,5-furandione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Bromo-2,5-furandione?
Yes, KEHONG BIO provides custom synthesis services for 3-Bromo-2,5-furandione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.