4,6-Dioxooct-2-enedioic acid
TL;DR: 4,6-Dioxooct-2-enedioic acid (CAS 5698-52-2) is a chemical compound with molecular formula C8H8O6 and molecular weight 200.03209 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4,6-dioxooct-2-enedioic acid
Also Known As: Fumarylacetoacetate, 4,6-dioxooct-2-enedioic acid, (2Z)4,6-DIOXOOCT-2-ENEDIOIC ACID, 2-Octenedioic acid,4,6-dioxo-, (Z)- (8CI,9CI)
Application Areas
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H8O6 |
| Molecular Weight | 200.03209 g/mol |
| XLogP | -0.7 |
| Topological Polar Surface Area (TPSA) | 109.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 200.03209 Da |
| Heavy Atoms | 14 |
| Complexity | 301.0 |
| SMILES | C(C(=O)CC(=O)O)C(=O)C=CC(=O)O |
| InChIKey | GACSIVHAIFQKTC-UHFFFAOYSA-N |
Product Description
Applications: 4,6-Dioxooct-2-enedioic acid is used in biotechnology workflows and life-science research, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 4,6-Dioxooct-2-enedioic acid (CAS 5698-52-2) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
4,6-Dioxooct-2-enedioic acid is a biotechnology compound identified by CAS number 5698-52-2 and the molecular formula C8H8O6 and a molecular weight of 200.03 g/mol. It is also known as Fumarylacetoacetate and 4,6-dioxooct-2-enedioic acid.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 4,6-Dioxooct-2-enedioic acid
Property Insights of 4,6-Dioxooct-2-enedioic acid
The XLogP value of -0.7 indicates that 4,6-Dioxooct-2-enedioic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,6-Dioxooct-2-enedioic acid. Following Lipinski's Rule of Five, 4,6-Dioxooct-2-enedioic acid has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4,6-Dioxooct-2-enedioic acid?
The CAS number of 4,6-Dioxooct-2-enedioic acid is 5698-52-2.
What is the molecular formula of 4,6-Dioxooct-2-enedioic acid?
The molecular formula of 4,6-Dioxooct-2-enedioic acid is C8H8O6.
What is the molecular weight of 4,6-Dioxooct-2-enedioic acid?
The molecular weight of 4,6-Dioxooct-2-enedioic acid is 200.03209 g/mol.
What are the applications of 4,6-Dioxooct-2-enedioic acid?
4,6-Dioxooct-2-enedioic acid is used in biotechnology workflows and life-science research, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 4,6-Dioxooct-2-enedioic acid (CAS 5698-52-2) with...
Where can I buy 4,6-Dioxooct-2-enedioic acid?
You can request a quote for 4,6-Dioxooct-2-enedioic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4,6-Dioxooct-2-enedioic acid?
Yes, CoreyChem provides custom synthesis services for 4,6-Dioxooct-2-enedioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.