4,5,6-Trichloro-2-(2,4-dichlorophenoxy)phenol
TL;DR: 4,5,6-Trichloro-2-(2,4-dichlorophenoxy)phenol (CAS 53555-01-4) is a chemical compound with molecular formula C12H5Cl5O2 and molecular weight 355.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,4-trichloro-6-(2,4-dichlorophenoxy)phenol
Also Known As: Predioxin, Cl5-Predioxin, C1(5)-predioxin, 2,3,4-Trichloro-6-(2,4-dichlorophenoxy)phenol, 4,5,6-Trichloro-2-(2,4-dichlorophenoxy)phenol
| Molecular Formula | C12H5Cl5O2 |
|---|---|
| Molecular Weight | 355.87 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 357.87027 |
| Heavy Atoms | 19 |
| Complexity | 306.0 |
Chemical Identifiers
| CAS Number | 53555-01-4 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)Cl)OC2=CC(=C(C(=C2O)Cl)Cl)Cl |
| InChIKey | PVLWIBDPWVHDIN-UHFFFAOYSA-N |
Product Overview
4,5,6-Trichloro-2-(2,4-dichlorophenoxy)phenol (CAS 53555-01-4), with molecular formula C12H5Cl5O2 and molecular weight 355.87 g/mol. IUPAC: 2,3,4-trichloro-6-(2,4-dichlorophenoxy)phenol.
Chemical Property Profile of 4,5,6-Trichloro-2-(2,4-dichlorophenoxy)phenol
Property Insights of 4,5,6-Trichloro-2-(2,4-dichlorophenoxy)phenol
The XLogP value of 6.2 indicates that 4,5,6-Trichloro-2-(2,4-dichlorophenoxy)phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 4,5,6-Trichloro-2-(2,4-dichlorophenoxy)phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5,6-Trichloro-2-(2,4-dichlorophenoxy)phenol has 1 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 4,5,6-Trichloro-2-(2,4-dichlorophenoxy)phenol?
The CAS number of 4,5,6-Trichloro-2-(2,4-dichlorophenoxy)phenol is 53555-01-4.
What is the molecular formula of 4,5,6-Trichloro-2-(2,4-dichlorophenoxy)phenol?
The molecular formula of 4,5,6-Trichloro-2-(2,4-dichlorophenoxy)phenol is C12H5Cl5O2.
What is the molecular weight of 4,5,6-Trichloro-2-(2,4-dichlorophenoxy)phenol?
The molecular weight of 4,5,6-Trichloro-2-(2,4-dichlorophenoxy)phenol is 355.87 g/mol.
Where can I buy 4,5,6-Trichloro-2-(2,4-dichlorophenoxy)phenol?
You can request a quote for 4,5,6-Trichloro-2-(2,4-dichlorophenoxy)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5,6-Trichloro-2-(2,4-dichlorophenoxy)phenol?
Yes, KEHONG BIO provides custom synthesis services for 4,5,6-Trichloro-2-(2,4-dichlorophenoxy)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.