Bisphenol A bis(3-chloro-2-hydroxypropyl) ether
TL;DR: Bisphenol A bis(3-chloro-2-hydroxypropyl) ether (CAS 4809-35-2) is a chemical compound with molecular formula C21H26Cl2O4 and molecular weight 412.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-3-[4-[2-[4-(3-chloro-2-hydroxypropoxy)phenyl]propan-2-yl]phenoxy]propan-2-ol
Also Known As: Bisphenol A bis(3-chloro-2-hydroxypropyl) ether, BAGGE chlorohydrin, BADGE-2HCl, BADGE.2HCl, MSK8705-100M
| Molecular Formula | C21H26Cl2O4 |
|---|---|
| Molecular Weight | 412.12 g/mol |
| LogP | 3.9695 |
| Topological Polar Surface Area | 58.92 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 412.12082 |
| Heavy Atoms | 27 |
| Complexity | 626.8327 |
Chemical Identifiers
| CAS Number | 4809-35-2 |
|---|---|
| SMILES | CC(C)(C1=CC=C(C=C1)OCC(CCl)O)C2=CC=C(C=C2)OCC(CCl)O |
Product Overview
Bisphenol A bis(3-chloro-2-hydroxypropyl) ether (CAS 4809-35-2), with molecular formula C21H26Cl2O4 and molecular weight 412.12 g/mol. IUPAC: 1-chloro-3-[4-[2-[4-(3-chloro-2-hydroxypropoxy)phenyl]propan-2-yl]phenoxy]propan-2-ol.
Chemical Property Profile of Bisphenol A bis(3-chloro-2-hydroxypropyl) ether
Property Insights of Bisphenol A bis(3-chloro-2-hydroxypropyl) ether
The XLogP value of 3.9695 indicates that Bisphenol A bis(3-chloro-2-hydroxypropyl) ether is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.92 Ų, Bisphenol A bis(3-chloro-2-hydroxypropyl) ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bisphenol A bis(3-chloro-2-hydroxypropyl) ether has 2 hydrogen bond donor(s) and 4 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 Bisphenol A bis(3-chloro-2-hydroxypropyl) ether?
The CAS number of Bisphenol A bis(3-chloro-2-hydroxypropyl) ether is 4809-35-2.
What is the molecular formula of Bisphenol A bis(3-chloro-2-hydroxypropyl) ether?
The molecular formula of Bisphenol A bis(3-chloro-2-hydroxypropyl) ether is C21H26Cl2O4.
What is the molecular weight of Bisphenol A bis(3-chloro-2-hydroxypropyl) ether?
The molecular weight of Bisphenol A bis(3-chloro-2-hydroxypropyl) ether is 412.12 g/mol.
Where can I buy Bisphenol A bis(3-chloro-2-hydroxypropyl) ether?
You can request a quote for Bisphenol A bis(3-chloro-2-hydroxypropyl) ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bisphenol A bis(3-chloro-2-hydroxypropyl) ether?
Yes, KEHONG BIO provides custom synthesis services for Bisphenol A bis(3-chloro-2-hydroxypropyl) ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.