Triallyl trimesate
TL;DR: Triallyl trimesate (CAS 17832-16-5) is a chemical compound with molecular formula C18H18O6 and molecular weight 330.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tris(prop-2-enyl) benzene-1,3,5-tricarboxylate
Also Known As: Triallyl trimesate, Triallyl 1,3,5-benzenetricarboxylate, Triallyl benzene-1,3,5-tricarboxylate, triallyltrimesate, Trimesic Acid Triallyl Ester
| Molecular Formula | C18H18O6 |
|---|---|
| Molecular Weight | 330.11 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 330.11035 |
| Heavy Atoms | 24 |
| Complexity | 412.0 |
Chemical Identifiers
| CAS Number | 17832-16-5 |
|---|---|
| SMILES | C=CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC=C)C(=O)OCC=C |
| InChIKey | VOSUIKFOFHZNED-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Triallyl trimesate (CAS 17832-16-5), with molecular formula C18H18O6 and molecular weight 330.11 g/mol. IUPAC: tris(prop-2-enyl) benzene-1,3,5-tricarboxylate.
Chemical Property Profile of Triallyl trimesate
Property Insights of Triallyl trimesate
The XLogP value of 3.4 indicates that Triallyl trimesate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Triallyl trimesate. Following Lipinski's Rule of Five, Triallyl trimesate has 0 hydrogen bond donor(s) and 6 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 Triallyl trimesate?
The CAS number of Triallyl trimesate is 17832-16-5.
What is the molecular formula of Triallyl trimesate?
The molecular formula of Triallyl trimesate is C18H18O6.
What is the molecular weight of Triallyl trimesate?
The molecular weight of Triallyl trimesate is 330.11 g/mol.
Where can I buy Triallyl trimesate?
You can request a quote for Triallyl trimesate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Triallyl trimesate?
Yes, KEHONG BIO provides custom synthesis services for Triallyl trimesate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.