1,1-Bis(4-chlorophenyl)ethanol
TL;DR: 1,1-Bis(4-chlorophenyl)ethanol (CAS 80-06-8) is a chemical compound with molecular formula C14H12Cl2O and molecular weight 266.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-bis(4-chlorophenyl)ethanol
Also Known As: Chlorfenethol, Micasin, Qikron, Mikazene, Quickron
| Molecular Formula | C14H12Cl2O |
|---|---|
| Molecular Weight | 266.03 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 266.02652 |
| Heavy Atoms | 17 |
| Complexity | 219.0 |
| Melting Point | 70 °C |
| Solubility | Sol in ether and benzene; insol in water and alcohol |
| Vapor Pressure | 0.00000054 [mmHg] |
Chemical Identifiers
| CAS Number | 80-06-8 |
|---|---|
| SMILES | CC(C1=CC=C(C=C1)Cl)(C2=CC=C(C=C2)Cl)O |
| InChIKey | URYAFVKLYSEINW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1-Bis(4-chlorophenyl)ethanol (CAS 80-06-8), with molecular formula C14H12Cl2O and molecular weight 266.03 g/mol. IUPAC: 1,1-bis(4-chlorophenyl)ethanol.
Chemical Property Profile of 1,1-Bis(4-chlorophenyl)ethanol
Property Insights of 1,1-Bis(4-chlorophenyl)ethanol
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1-Bis(4-chlorophenyl)ethanol. With a topological polar surface area (TPSA) of 20.2 Ų, 1,1-Bis(4-chlorophenyl)ethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1-Bis(4-chlorophenyl)ethanol has 1 hydrogen bond donor(s) and 1 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 1,1-Bis(4-chlorophenyl)ethanol?
The CAS number of 1,1-Bis(4-chlorophenyl)ethanol is 80-06-8.
What is the molecular formula of 1,1-Bis(4-chlorophenyl)ethanol?
The molecular formula of 1,1-Bis(4-chlorophenyl)ethanol is C14H12Cl2O.
What is the molecular weight of 1,1-Bis(4-chlorophenyl)ethanol?
The molecular weight of 1,1-Bis(4-chlorophenyl)ethanol is 266.03 g/mol.
Where can I buy 1,1-Bis(4-chlorophenyl)ethanol?
You can request a quote for 1,1-Bis(4-chlorophenyl)ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1-Bis(4-chlorophenyl)ethanol?
Yes, KEHONG BIO provides custom synthesis services for 1,1-Bis(4-chlorophenyl)ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.