![Bis[2-(4-bromophenyl)-2-oxoethyl] oxalate structure](/static/products/3013/3013-44-3.webp)
Bis[2-(4-bromophenyl)-2-oxoethyl] oxalate
TL;DR: Bis[2-(4-bromophenyl)-2-oxoethyl] oxalate (CAS 3013-44-3) is a chemical compound with molecular formula C18H12Br2O6 and molecular weight 481.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis[2-(4-bromophenyl)-2-oxoethyl] oxalate
Also Known As: Bis(4'-bromophenacyl) oxalate, Bis[2-(4-bromophenyl)-2-oxoethyl] oxalate, bis[2-(4-bromophenyl)-2-oxoethyl] ethanedioate, 1,2-Bis[2-(4-bromophenyl)-2-oxoethyl] ethanedioate, bis(2-(4-bromophenyl)-2-oxoethyl) oxalate
| Molecular Formula | C18H12Br2O6 |
|---|---|
| Molecular Weight | 481.90 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 86.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 481.90005 |
| Heavy Atoms | 26 |
| Complexity | 486.0 |
Chemical Identifiers
| CAS Number | 3013-44-3 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)COC(=O)C(=O)OCC(=O)C2=CC=C(C=C2)Br)Br |
| InChIKey | MWCOFNVRVIDQAB-UHFFFAOYSA-N |
Product Overview
Bis[2-(4-bromophenyl)-2-oxoethyl] oxalate (CAS 3013-44-3), with molecular formula C18H12Br2O6 and molecular weight 481.90 g/mol. IUPAC: bis[2-(4-bromophenyl)-2-oxoethyl] oxalate.
Chemical Property Profile of Bis[2-(4-bromophenyl)-2-oxoethyl] oxalate
Property Insights of Bis[2-(4-bromophenyl)-2-oxoethyl] oxalate
The XLogP value of 4.6 indicates that Bis[2-(4-bromophenyl)-2-oxoethyl] oxalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Bis[2-(4-bromophenyl)-2-oxoethyl] oxalate. Following Lipinski's Rule of Five, Bis[2-(4-bromophenyl)-2-oxoethyl] oxalate 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 Bis[2-(4-bromophenyl)-2-oxoethyl] oxalate?
The CAS number of Bis[2-(4-bromophenyl)-2-oxoethyl] oxalate is 3013-44-3.
What is the molecular formula of Bis[2-(4-bromophenyl)-2-oxoethyl] oxalate?
The molecular formula of Bis[2-(4-bromophenyl)-2-oxoethyl] oxalate is C18H12Br2O6.
What is the molecular weight of Bis[2-(4-bromophenyl)-2-oxoethyl] oxalate?
The molecular weight of Bis[2-(4-bromophenyl)-2-oxoethyl] oxalate is 481.90 g/mol.
Where can I buy Bis[2-(4-bromophenyl)-2-oxoethyl] oxalate?
You can request a quote for Bis[2-(4-bromophenyl)-2-oxoethyl] oxalate 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-bromophenyl)-2-oxoethyl] oxalate?
Yes, KEHONG BIO provides custom synthesis services for Bis[2-(4-bromophenyl)-2-oxoethyl] oxalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.