延胡索醯乙醯乙酸
TL;DR: 延胡索醯乙醯乙酸 (CAS 9032-59-1) is a chemical compound with molecular formula C8H8O6 and molecular weight 200.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
延胡索醯乙醯乙酸
(E)-4,6-dioxooct-2-enedioic acid
Also Known As: Fumarylacetoacetate, 4-Fumarylacetoacetic acid, Fumarylacetoacetone, fumarylacetoacetic acid, 4-Fumarylacetoacetate
| Molecular Formula | C8H8O6 |
|---|---|
| Molecular Weight | 200.03 g/mol |
| LogP | -0.3698 |
| Topological Polar Surface Area | 108.74 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 200.03209 |
| Heavy Atoms | 14 |
| Complexity | 300.95337 |
Chemical Identifiers
| CAS Number | 9032-59-1 |
|---|---|
| SMILES | C(C(=O)CC(=O)O)C(=O)/C=C/C(=O)O |
Product Overview
延胡索醯乙醯乙酸 (CAS 9032-59-1), with molecular formula C8H8O6 and molecular weight 200.03 g/mol. IUPAC: (E)-4,6-dioxooct-2-enedioic acid.
Chemical Property Profile of 延胡索醯乙醯乙酸
Property Insights of 延胡索醯乙醯乙酸
The XLogP value of -0.3698 indicates that 延胡索醯乙醯乙酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 108.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 延胡索醯乙醯乙酸. Following Lipinski's Rule of Five, 延胡索醯乙醯乙酸 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
Frequently Asked Questions
What is the CAS number of 延胡索醯乙醯乙酸?
The CAS number of 延胡索醯乙醯乙酸 is 9032-59-1.
What is the molecular formula of 延胡索醯乙醯乙酸?
The molecular formula of 延胡索醯乙醯乙酸 is C8H8O6.
What is the molecular weight of 延胡索醯乙醯乙酸?
The molecular weight of 延胡索醯乙醯乙酸 is 200.03 g/mol.
Where can I buy 延胡索醯乙醯乙酸?
You can request a quote for 延胡索醯乙醯乙酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 延胡索醯乙醯乙酸?
Yes, KEHONG BIO provides custom synthesis services for 延胡索醯乙醯乙酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.