Ethyl bis(3,5-dibromo-4-hydroxyphenyl)acetate
TL;DR: Ethyl bis(3,5-dibromo-4-hydroxyphenyl)acetate (CAS 94159-40-7) is a chemical compound with molecular formula C16H12Br4O4 and molecular weight 583.75 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2,2-bis(3,5-dibromo-4-hydroxyphenyl)acetate
Also Known As: ethylbis acetate, Ethyl bis(3,5-dibromo-4-hydroxyphenyl)acetate, EINECS 303-219-2, ethyl 2,2-bis(3,5-dibromo-4-hydroxyphenyl)acetate, ETHYL 3,5-DIBROMO-.ALPHA.-(3,5-DIBROMO-4-HYDROXYPHENYL)-4-HYDROXYBENZENEACETATE
| Molecular Formula | C16H12Br4O4 |
|---|---|
| Molecular Weight | 583.75 g/mol |
| LogP | 5.8428 |
| Topological Polar Surface Area | 66.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 583.7469 |
| Heavy Atoms | 24 |
| Complexity | 688.13226 |
Chemical Identifiers
| CAS Number | 94159-40-7 |
|---|---|
| SMILES | CCOC(=O)C(C1=CC(=C(C(=C1)Br)O)Br)C2=CC(=C(C(=C2)Br)O)Br |
Product Overview
Ethyl bis(3,5-dibromo-4-hydroxyphenyl)acetate (CAS 94159-40-7), with molecular formula C16H12Br4O4 and molecular weight 583.75 g/mol. IUPAC: ethyl 2,2-bis(3,5-dibromo-4-hydroxyphenyl)acetate.
Chemical Property Profile of Ethyl bis(3,5-dibromo-4-hydroxyphenyl)acetate
Property Insights of Ethyl bis(3,5-dibromo-4-hydroxyphenyl)acetate
The XLogP value of 5.8428 indicates that Ethyl bis(3,5-dibromo-4-hydroxyphenyl)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.76 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl bis(3,5-dibromo-4-hydroxyphenyl)acetate. Following Lipinski's Rule of Five, Ethyl bis(3,5-dibromo-4-hydroxyphenyl)acetate has 2 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 Ethyl bis(3,5-dibromo-4-hydroxyphenyl)acetate?
The CAS number of Ethyl bis(3,5-dibromo-4-hydroxyphenyl)acetate is 94159-40-7.
What is the molecular formula of Ethyl bis(3,5-dibromo-4-hydroxyphenyl)acetate?
The molecular formula of Ethyl bis(3,5-dibromo-4-hydroxyphenyl)acetate is C16H12Br4O4.
What is the molecular weight of Ethyl bis(3,5-dibromo-4-hydroxyphenyl)acetate?
The molecular weight of Ethyl bis(3,5-dibromo-4-hydroxyphenyl)acetate is 583.75 g/mol.
Where can I buy Ethyl bis(3,5-dibromo-4-hydroxyphenyl)acetate?
You can request a quote for Ethyl bis(3,5-dibromo-4-hydroxyphenyl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl bis(3,5-dibromo-4-hydroxyphenyl)acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl bis(3,5-dibromo-4-hydroxyphenyl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.