Pentachlorophenetole
TL;DR: Pentachlorophenetole (CAS 10463-10-2) is a chemical compound with molecular formula C8H5Cl5O and molecular weight 291.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,4,5-pentachloro-6-ethoxybenzene
Also Known As: Pentachlorophenetole, Benzene, pentachloroethoxy-, 1,2,3,4,5-Pentachloro-6-ethoxybenzene, monoethoxypentachlorobenzene, Pentachlorphenyl-ethylether
| Molecular Formula | C8H5Cl5O |
|---|---|
| Molecular Weight | 291.88 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 293.87537 |
| Heavy Atoms | 14 |
| Complexity | 175.0 |
Chemical Identifiers
| CAS Number | 10463-10-2 |
|---|---|
| SMILES | CCOC1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl |
| InChIKey | YXNDWTIYDLVODL-UHFFFAOYSA-N |
Product Overview
Pentachlorophenetole (CAS 10463-10-2), with molecular formula C8H5Cl5O and molecular weight 291.88 g/mol. IUPAC: 1,2,3,4,5-pentachloro-6-ethoxybenzene.
Chemical Property Profile of Pentachlorophenetole
Property Insights of Pentachlorophenetole
The XLogP value of 5.4 indicates that Pentachlorophenetole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, Pentachlorophenetole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pentachlorophenetole has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pentachlorophenetole?
The CAS number of Pentachlorophenetole is 10463-10-2.
What is the molecular formula of Pentachlorophenetole?
The molecular formula of Pentachlorophenetole is C8H5Cl5O.
What is the molecular weight of Pentachlorophenetole?
The molecular weight of Pentachlorophenetole is 291.88 g/mol.
Where can I buy Pentachlorophenetole?
You can request a quote for Pentachlorophenetole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pentachlorophenetole?
Yes, KEHONG BIO provides custom synthesis services for Pentachlorophenetole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.