4,4'-(2,2-Dichloroethylidene)bisphenol
TL;DR: 4,4'-(2,2-Dichloroethylidene)bisphenol (CAS 13005-40-8) is a chemical compound with molecular formula C14H12Cl2O2 and molecular weight 282.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2,2-dichloro-1-(4-hydroxyphenyl)ethyl]phenol
Also Known As: 4,4'-(2,2-Dichloroethylidene)bisphenol, 2,2-Bis(p-hydroxyphenyl)-1,1-dichloroethane, Phenol, 4,4'-(2,2-dichloroethylidene)di-, Phenol, 4,4'-(2,2-dichloroethylidene)bis-, Bis(triphenylphosphine)dicarbonylnickel
| Molecular Formula | C14H12Cl2O2 |
|---|---|
| Molecular Weight | 282.02 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 282.02142 |
| Heavy Atoms | 18 |
| Complexity | 222.0 |
Chemical Identifiers
| CAS Number | 13005-40-8 |
|---|---|
| SMILES | C1=CC(=CC=C1C(C2=CC=C(C=C2)O)C(Cl)Cl)O |
| InChIKey | YVQVKDACGUDFMB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,4'-(2,2-Dichloroethylidene)bisphenol (CAS 13005-40-8), with molecular formula C14H12Cl2O2 and molecular weight 282.02 g/mol. IUPAC: 4-[2,2-dichloro-1-(4-hydroxyphenyl)ethyl]phenol.
Chemical Property Profile of 4,4'-(2,2-Dichloroethylidene)bisphenol
Property Insights of 4,4'-(2,2-Dichloroethylidene)bisphenol
The XLogP value of 4.3 indicates that 4,4'-(2,2-Dichloroethylidene)bisphenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, 4,4'-(2,2-Dichloroethylidene)bisphenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4'-(2,2-Dichloroethylidene)bisphenol has 2 hydrogen bond donor(s) and 2 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 4,4'-(2,2-Dichloroethylidene)bisphenol?
The CAS number of 4,4'-(2,2-Dichloroethylidene)bisphenol is 13005-40-8.
What is the molecular formula of 4,4'-(2,2-Dichloroethylidene)bisphenol?
The molecular formula of 4,4'-(2,2-Dichloroethylidene)bisphenol is C14H12Cl2O2.
What is the molecular weight of 4,4'-(2,2-Dichloroethylidene)bisphenol?
The molecular weight of 4,4'-(2,2-Dichloroethylidene)bisphenol is 282.02 g/mol.
Where can I buy 4,4'-(2,2-Dichloroethylidene)bisphenol?
You can request a quote for 4,4'-(2,2-Dichloroethylidene)bisphenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4'-(2,2-Dichloroethylidene)bisphenol?
Yes, KEHONG BIO provides custom synthesis services for 4,4'-(2,2-Dichloroethylidene)bisphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.