Bis(2,4,6-trichlorophenyl) ethylpropanedioate
TL;DR: Bis(2,4,6-trichlorophenyl) ethylpropanedioate (CAS 15781-72-3) is a chemical compound with molecular formula C17H10Cl6O4 and molecular weight 487.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2,4,6-trichlorophenyl) 2-ethylpropanedioate
Also Known As: Bis(2,4,6-trichlorophenyl) 2-ethylpropanedioate, Bis(2,4,6-trichlorophenyl) ethylpropanedioate, J1.117.073K, syn-Bis(2,4,6-trichlorophenyl) 2-ethylmalonate, BIS(2,4,6-TRICHLOROPHENYL) ETHYLMALONATE
| Molecular Formula | C17H10Cl6O4 |
|---|---|
| Molecular Weight | 487.87 g/mol |
| LogP | 7.1442 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 487.87103 |
| Heavy Atoms | 27 |
| Complexity | 781.4777 |
Chemical Identifiers
| CAS Number | 15781-72-3 |
|---|---|
| SMILES | CCC(C(=O)OC1=C(C=C(C=C1Cl)Cl)Cl)C(=O)OC2=C(C=C(C=C2Cl)Cl)Cl |
Product Overview
Bis(2,4,6-trichlorophenyl) ethylpropanedioate (CAS 15781-72-3), with molecular formula C17H10Cl6O4 and molecular weight 487.87 g/mol. IUPAC: bis(2,4,6-trichlorophenyl) 2-ethylpropanedioate.
Chemical Property Profile of Bis(2,4,6-trichlorophenyl) ethylpropanedioate
Property Insights of Bis(2,4,6-trichlorophenyl) ethylpropanedioate
The XLogP value of 7.1442 indicates that Bis(2,4,6-trichlorophenyl) ethylpropanedioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Bis(2,4,6-trichlorophenyl) ethylpropanedioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bis(2,4,6-trichlorophenyl) ethylpropanedioate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bis(2,4,6-trichlorophenyl) ethylpropanedioate?
The CAS number of Bis(2,4,6-trichlorophenyl) ethylpropanedioate is 15781-72-3.
What is the molecular formula of Bis(2,4,6-trichlorophenyl) ethylpropanedioate?
The molecular formula of Bis(2,4,6-trichlorophenyl) ethylpropanedioate is C17H10Cl6O4.
What is the molecular weight of Bis(2,4,6-trichlorophenyl) ethylpropanedioate?
The molecular weight of Bis(2,4,6-trichlorophenyl) ethylpropanedioate is 487.87 g/mol.
Where can I buy Bis(2,4,6-trichlorophenyl) ethylpropanedioate?
You can request a quote for Bis(2,4,6-trichlorophenyl) ethylpropanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(2,4,6-trichlorophenyl) ethylpropanedioate?
Yes, KEHONG BIO provides custom synthesis services for Bis(2,4,6-trichlorophenyl) ethylpropanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.