![Bis[2-(4-bromophenyl)-2-oxoethyl] hexanedioate structure](/static/products/3013/3013-48-7.webp)
Bis[2-(4-bromophenyl)-2-oxoethyl] hexanedioate
TL;DR: Bis[2-(4-bromophenyl)-2-oxoethyl] hexanedioate (CAS 3013-48-7) is a chemical compound with molecular formula C22H20Br2O6 and molecular weight 537.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis[2-(4-bromophenyl)-2-oxoethyl] hexanedioate
Also Known As: bis[2-(4-bromophenyl)-2-oxoethyl] hexanedioate, Carvacryl N-2,3-xylylanthranilate, AB01334257-02, di2-(4-bromophenyl)-2-oxoethyl hexane-1,6-dioate, Hexanedioic acid,1,6-bis[2-(4-bromophenyl)-2-oxoethyl] ester
| Molecular Formula | C22H20Br2O6 |
|---|---|
| Molecular Weight | 537.96 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 86.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 13 |
| Exact Mass | 537.96265 |
| Heavy Atoms | 30 |
| Complexity | 540.0 |
Chemical Identifiers
| CAS Number | 3013-48-7 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)COC(=O)CCCCC(=O)OCC(=O)C2=CC=C(C=C2)Br)Br |
| InChIKey | ZMMIWCOQCSKBQZ-UHFFFAOYSA-N |
Product Overview
Bis[2-(4-bromophenyl)-2-oxoethyl] hexanedioate (CAS 3013-48-7), with molecular formula C22H20Br2O6 and molecular weight 537.96 g/mol. IUPAC: bis[2-(4-bromophenyl)-2-oxoethyl] hexanedioate.
Chemical Property Profile of Bis[2-(4-bromophenyl)-2-oxoethyl] hexanedioate
Property Insights of Bis[2-(4-bromophenyl)-2-oxoethyl] hexanedioate
The XLogP value of 4.8 indicates that Bis[2-(4-bromophenyl)-2-oxoethyl] hexanedioate 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] hexanedioate. Following Lipinski's Rule of Five, Bis[2-(4-bromophenyl)-2-oxoethyl] hexanedioate 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 Bis[2-(4-bromophenyl)-2-oxoethyl] hexanedioate?
The CAS number of Bis[2-(4-bromophenyl)-2-oxoethyl] hexanedioate is 3013-48-7.
What is the molecular formula of Bis[2-(4-bromophenyl)-2-oxoethyl] hexanedioate?
The molecular formula of Bis[2-(4-bromophenyl)-2-oxoethyl] hexanedioate is C22H20Br2O6.
What is the molecular weight of Bis[2-(4-bromophenyl)-2-oxoethyl] hexanedioate?
The molecular weight of Bis[2-(4-bromophenyl)-2-oxoethyl] hexanedioate is 537.96 g/mol.
Where can I buy Bis[2-(4-bromophenyl)-2-oxoethyl] hexanedioate?
You can request a quote for Bis[2-(4-bromophenyl)-2-oxoethyl] hexanedioate 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] hexanedioate?
Yes, KEHONG BIO provides custom synthesis services for Bis[2-(4-bromophenyl)-2-oxoethyl] hexanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.