Bis(2,4,5-trichlorophenyl) cyclobutane-1,2-dicarboxylate
TL;DR: Bis(2,4,5-trichlorophenyl) cyclobutane-1,2-dicarboxylate (CAS 64011-98-9) is a chemical compound with molecular formula C18H10Cl6O4 and molecular weight 499.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2,4,5-trichlorophenyl) cyclobutane-1,2-dicarboxylate
Also Known As: 1,bis(2,4,5-trichlorophenyl) ester, 1, bis(2,4,5-trichlorophenyl) ester, bis(2,4,5-trichlorophenyl) cyclobutane-1,2-dicarboxylate, Bis(2,4,5-trichlorophenyl)-1,2-cyclobutane dicarboxylate, Cyclobutane-1,2-dicarboxylic acid bis(2,4,5-trichlorophenyl) ester
| Molecular Formula | C18H10Cl6O4 |
|---|---|
| Molecular Weight | 499.87 g/mol |
| LogP | 7.3 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 501.86807 |
| Heavy Atoms | 28 |
| Complexity | 542.0 |
Chemical Identifiers
| CAS Number | 64011-98-9 |
|---|---|
| SMILES | C1CC(C1C(=O)OC2=CC(=C(C=C2Cl)Cl)Cl)C(=O)OC3=CC(=C(C=C3Cl)Cl)Cl |
| InChIKey | UGCKKVQVFGJJOD-UHFFFAOYSA-N |
Product Overview
Bis(2,4,5-trichlorophenyl) cyclobutane-1,2-dicarboxylate (CAS 64011-98-9), with molecular formula C18H10Cl6O4 and molecular weight 499.87 g/mol. IUPAC: bis(2,4,5-trichlorophenyl) cyclobutane-1,2-dicarboxylate.
Chemical Property Profile of Bis(2,4,5-trichlorophenyl) cyclobutane-1,2-dicarboxylate
Property Insights of Bis(2,4,5-trichlorophenyl) cyclobutane-1,2-dicarboxylate
The XLogP value of 7.3 indicates that Bis(2,4,5-trichlorophenyl) cyclobutane-1,2-dicarboxylate 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(2,4,5-trichlorophenyl) cyclobutane-1,2-dicarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bis(2,4,5-trichlorophenyl) cyclobutane-1,2-dicarboxylate 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(2,4,5-trichlorophenyl) cyclobutane-1,2-dicarboxylate?
The CAS number of Bis(2,4,5-trichlorophenyl) cyclobutane-1,2-dicarboxylate is 64011-98-9.
What is the molecular formula of Bis(2,4,5-trichlorophenyl) cyclobutane-1,2-dicarboxylate?
The molecular formula of Bis(2,4,5-trichlorophenyl) cyclobutane-1,2-dicarboxylate is C18H10Cl6O4.
What is the molecular weight of Bis(2,4,5-trichlorophenyl) cyclobutane-1,2-dicarboxylate?
The molecular weight of Bis(2,4,5-trichlorophenyl) cyclobutane-1,2-dicarboxylate is 499.87 g/mol.
Where can I buy Bis(2,4,5-trichlorophenyl) cyclobutane-1,2-dicarboxylate?
You can request a quote for Bis(2,4,5-trichlorophenyl) cyclobutane-1,2-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(2,4,5-trichlorophenyl) cyclobutane-1,2-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Bis(2,4,5-trichlorophenyl) cyclobutane-1,2-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.