Tris(4-methylpentan-2-yl) propane-1,2,3-tricarboxylate
TL;DR: Tris(4-methylpentan-2-yl) propane-1,2,3-tricarboxylate (CAS 61345-83-3) is a chemical compound with molecular formula C24H44O6 and molecular weight 428.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tris(4-methylpentan-2-yl) propane-1,2,3-tricarboxylate
Also Known As: tris(4-methylpentan-2-yl) propane-1,2,3-tricarboxylate, Propan-1,2,3-tricarbonsaeure-tris-(1,3-dimethyl-butylester), 1,2,3-Propanetricarboxylicacid, 1,2,3-tris(1,3-dimethylbutyl) ester, 1,3-PROPANETRICARBOXYLIC ACID, TRIS(1,3-DIMETHYLBUTYL) ESTER
| Molecular Formula | C24H44O6 |
|---|---|
| Molecular Weight | 428.31 g/mol |
| LogP | 6.1 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 17 |
| Exact Mass | 428.31378 |
| Heavy Atoms | 30 |
| Complexity | 494.0 |
Chemical Identifiers
| CAS Number | 61345-83-3 |
|---|---|
| SMILES | CC(C)CC(C)OC(=O)CC(CC(=O)OC(C)CC(C)C)C(=O)OC(C)CC(C)C |
| InChIKey | XBNWCMUBZMWBGY-UHFFFAOYSA-N |
Product Overview
Tris(4-methylpentan-2-yl) propane-1,2,3-tricarboxylate (CAS 61345-83-3), with molecular formula C24H44O6 and molecular weight 428.31 g/mol. IUPAC: tris(4-methylpentan-2-yl) propane-1,2,3-tricarboxylate.
Chemical Property Profile of Tris(4-methylpentan-2-yl) propane-1,2,3-tricarboxylate
Property Insights of Tris(4-methylpentan-2-yl) propane-1,2,3-tricarboxylate
The XLogP value of 6.1 indicates that Tris(4-methylpentan-2-yl) propane-1,2,3-tricarboxylate 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 Tris(4-methylpentan-2-yl) propane-1,2,3-tricarboxylate. Following Lipinski's Rule of Five, Tris(4-methylpentan-2-yl) propane-1,2,3-tricarboxylate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tris(4-methylpentan-2-yl) propane-1,2,3-tricarboxylate?
The CAS number of Tris(4-methylpentan-2-yl) propane-1,2,3-tricarboxylate is 61345-83-3.
What is the molecular formula of Tris(4-methylpentan-2-yl) propane-1,2,3-tricarboxylate?
The molecular formula of Tris(4-methylpentan-2-yl) propane-1,2,3-tricarboxylate is C24H44O6.
What is the molecular weight of Tris(4-methylpentan-2-yl) propane-1,2,3-tricarboxylate?
The molecular weight of Tris(4-methylpentan-2-yl) propane-1,2,3-tricarboxylate is 428.31 g/mol.
Where can I buy Tris(4-methylpentan-2-yl) propane-1,2,3-tricarboxylate?
You can request a quote for Tris(4-methylpentan-2-yl) propane-1,2,3-tricarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tris(4-methylpentan-2-yl) propane-1,2,3-tricarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Tris(4-methylpentan-2-yl) propane-1,2,3-tricarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.