2,3-Dibromomalealdehydic acid
TL;DR: 2,3-Dibromomalealdehydic acid (CAS 488-11-9) is a chemical compound with molecular formula C4H2Br2O3 and molecular weight 255.84 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dibromo-4-oxobut-2-enoic acid
Also Known As: Mucobromic acid, Mucobromicacid, 2,3-Dibromomalealdehydic acid, 2,3-dibromo-4-oxobut-2-enoic acid, 2,3-Dibromo-4-oxo-2-butenoic acid
| Molecular Formula | C4H2Br2O3 |
|---|---|
| Molecular Weight | 255.84 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 257.83502 |
| Heavy Atoms | 9 |
| Complexity | 173.0 |
Chemical Identifiers
| CAS Number | 488-11-9 |
|---|---|
| SMILES | C(=O)C(=C(C(=O)O)Br)Br |
| InChIKey | NCNYEGJDGNOYJX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,3-Dibromomalealdehydic acid (CAS 488-11-9), with molecular formula C4H2Br2O3 and molecular weight 255.84 g/mol. IUPAC: 2,3-dibromo-4-oxobut-2-enoic acid.
Chemical Property Profile of 2,3-Dibromomalealdehydic acid
Property Insights of 2,3-Dibromomalealdehydic acid
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-Dibromomalealdehydic acid. With a topological polar surface area (TPSA) of 54.4 Ų, 2,3-Dibromomalealdehydic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Dibromomalealdehydic acid has 1 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 2,3-Dibromomalealdehydic acid?
The CAS number of 2,3-Dibromomalealdehydic acid is 488-11-9.
What is the molecular formula of 2,3-Dibromomalealdehydic acid?
The molecular formula of 2,3-Dibromomalealdehydic acid is C4H2Br2O3.
What is the molecular weight of 2,3-Dibromomalealdehydic acid?
The molecular weight of 2,3-Dibromomalealdehydic acid is 255.84 g/mol.
Where can I buy 2,3-Dibromomalealdehydic acid?
You can request a quote for 2,3-Dibromomalealdehydic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Dibromomalealdehydic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Dibromomalealdehydic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.