Estrobin
TL;DR: Estrobin (CAS 60883-74-1) is a chemical compound with molecular formula C24H23BrO2 and molecular weight 422.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-bromo-1-(4-ethoxyphenyl)-2-phenylethenyl]-4-ethoxybenzene
Also Known As: Estrobin, triphenylstilbene, alpha-Bromo-beta,beta-bis(p-ethoxyphenyl)styrene, Styrene, alpha-bromo-beta,beta-bis(p-ethoxyphenyl)-, Benzene, 1,1'-(bromophenylethenylidene)bis(4-ethoxy-
| Molecular Formula | C24H23BrO2 |
|---|---|
| Molecular Weight | 422.09 g/mol |
| LogP | 7.2 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 422.08813 |
| Heavy Atoms | 27 |
| Complexity | 425.0 |
Chemical Identifiers
| CAS Number | 60883-74-1 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C(=C(C2=CC=CC=C2)Br)C3=CC=C(C=C3)OCC |
| InChIKey | BYILAACWNFQDGZ-UHFFFAOYSA-N |
Product Overview
Estrobin (CAS 60883-74-1), with molecular formula C24H23BrO2 and molecular weight 422.09 g/mol. IUPAC: 1-[2-bromo-1-(4-ethoxyphenyl)-2-phenylethenyl]-4-ethoxybenzene.
Chemical Property Profile of Estrobin
Property Insights of Estrobin
The XLogP value of 7.2 indicates that Estrobin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, Estrobin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Estrobin has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Estrobin?
The CAS number of Estrobin is 60883-74-1.
What is the molecular formula of Estrobin?
The molecular formula of Estrobin is C24H23BrO2.
What is the molecular weight of Estrobin?
The molecular weight of Estrobin is 422.09 g/mol.
Where can I buy Estrobin?
You can request a quote for Estrobin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Estrobin?
Yes, KEHONG BIO provides custom synthesis services for Estrobin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.