3,6-Dioxocyclohexa-1,4-diene-1,2,4,5-tetrayl tetrakis(3-methylbutanoate)
TL;DR: 3,6-Dioxocyclohexa-1,4-diene-1,2,4,5-tetrayl tetrakis(3-methylbutanoate) (CAS 28293-26-7) is a chemical compound with molecular formula C26H36O10 and molecular weight 508.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2,4,5-tris(3-methylbutanoyloxy)-3,6-dioxocyclohexa-1,4-dien-1-yl] 3-methylbutanoate
Also Known As: 3,6-dioxocyclohexa-1,4-diene-1,2,4,5-tetrayl tetrakis(3-methylbutanoate), [2,4,5-tris(3-methylbutanoyloxy)-3,6-dioxocyclohexa-1,4-dien-1-yl] 3-methylbutanoate, Butanoic acid,3-methyl-, 3,6-dioxo-1,4-cyclohexadiene-1,2,4,5-tetrayl ester (9CI)
| Molecular Formula | C26H36O10 |
|---|---|
| Molecular Weight | 508.23 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 139.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 16 |
| Exact Mass | 508.23083 |
| Heavy Atoms | 36 |
| Complexity | 813.0 |
Chemical Identifiers
| CAS Number | 28293-26-7 |
|---|---|
| SMILES | CC(C)CC(=O)OC1=C(C(=O)C(=C(C1=O)OC(=O)CC(C)C)OC(=O)CC(C)C)OC(=O)CC(C)C |
| InChIKey | WHKQXYKMUPBFEY-UHFFFAOYSA-N |
Product Overview
3,6-Dioxocyclohexa-1,4-diene-1,2,4,5-tetrayl tetrakis(3-methylbutanoate) (CAS 28293-26-7), with molecular formula C26H36O10 and molecular weight 508.23 g/mol. IUPAC: [2,4,5-tris(3-methylbutanoyloxy)-3,6-dioxocyclohexa-1,4-dien-1-yl] 3-methylbutanoate.
Chemical Property Profile of 3,6-Dioxocyclohexa-1,4-diene-1,2,4,5-tetrayl tetrakis(3-methylbutanoate)
Property Insights of 3,6-Dioxocyclohexa-1,4-diene-1,2,4,5-tetrayl tetrakis(3-methylbutanoate)
The XLogP value of 4.9 indicates that 3,6-Dioxocyclohexa-1,4-diene-1,2,4,5-tetrayl tetrakis(3-methylbutanoate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 139.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,6-Dioxocyclohexa-1,4-diene-1,2,4,5-tetrayl tetrakis(3-methylbutanoate). Following Lipinski's Rule of Five, 3,6-Dioxocyclohexa-1,4-diene-1,2,4,5-tetrayl tetrakis(3-methylbutanoate) has 0 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,6-Dioxocyclohexa-1,4-diene-1,2,4,5-tetrayl tetrakis(3-methylbutanoate)?
The CAS number of 3,6-Dioxocyclohexa-1,4-diene-1,2,4,5-tetrayl tetrakis(3-methylbutanoate) is 28293-26-7.
What is the molecular formula of 3,6-Dioxocyclohexa-1,4-diene-1,2,4,5-tetrayl tetrakis(3-methylbutanoate)?
The molecular formula of 3,6-Dioxocyclohexa-1,4-diene-1,2,4,5-tetrayl tetrakis(3-methylbutanoate) is C26H36O10.
What is the molecular weight of 3,6-Dioxocyclohexa-1,4-diene-1,2,4,5-tetrayl tetrakis(3-methylbutanoate)?
The molecular weight of 3,6-Dioxocyclohexa-1,4-diene-1,2,4,5-tetrayl tetrakis(3-methylbutanoate) is 508.23 g/mol.
Where can I buy 3,6-Dioxocyclohexa-1,4-diene-1,2,4,5-tetrayl tetrakis(3-methylbutanoate)?
You can request a quote for 3,6-Dioxocyclohexa-1,4-diene-1,2,4,5-tetrayl tetrakis(3-methylbutanoate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,6-Dioxocyclohexa-1,4-diene-1,2,4,5-tetrayl tetrakis(3-methylbutanoate)?
Yes, KEHONG BIO provides custom synthesis services for 3,6-Dioxocyclohexa-1,4-diene-1,2,4,5-tetrayl tetrakis(3-methylbutanoate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.