3-Hydroxynonachlorodiphenyl ether
TL;DR: 3-Hydroxynonachlorodiphenyl ether (CAS 42255-14-1) is a chemical compound with molecular formula C12HCl9O2 and molecular weight 491.71732 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,3,4,6-tetrachloro-5-(2,3,4,5,6-pentachlorophenoxy)phenol
Also Known As: Isopredioxin, 3-Hydroxynonachlorodiphenyl ether, Nonachloro-3-phenoxyphenol, 3-Hydroxy-nonachlorodiphenyl ether, 2,3,4,6-Tetrachloro-5-(pentachlorophenoxy)phenol
Technical Specifications
| Molecular Formula | C12HCl9O2 |
| Molecular Weight | 491.71732 g/mol |
| XLogP | 9.2 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 495.71143 Da |
| Heavy Atoms | 23 |
| Complexity | 400.0 |
| SMILES | C1(=C(C(=C(C(=C1Cl)Cl)Cl)OC2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)Cl)Cl)O |
| InChIKey | GFTSIDLUOSZZIW-UHFFFAOYSA-N |
Chemical Property Profile of 3-Hydroxynonachlorodiphenyl ether
Property Insights of 3-Hydroxynonachlorodiphenyl ether
The XLogP value of 9.2 indicates that 3-Hydroxynonachlorodiphenyl ether is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 3-Hydroxynonachlorodiphenyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Hydroxynonachlorodiphenyl ether has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 3-Hydroxynonachlorodiphenyl ether?
The CAS number of 3-Hydroxynonachlorodiphenyl ether is 42255-14-1.
What is the molecular formula of 3-Hydroxynonachlorodiphenyl ether?
The molecular formula of 3-Hydroxynonachlorodiphenyl ether is C12HCl9O2.
What is the molecular weight of 3-Hydroxynonachlorodiphenyl ether?
The molecular weight of 3-Hydroxynonachlorodiphenyl ether is 491.71732 g/mol.
Where can I buy 3-Hydroxynonachlorodiphenyl ether?
You can request a quote for 3-Hydroxynonachlorodiphenyl ether directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Hydroxynonachlorodiphenyl ether?
Yes, CoreyChem provides custom synthesis services for 3-Hydroxynonachlorodiphenyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.