Pentachloroethylbenzene
TL;DR: Pentachloroethylbenzene (CAS 606-07-5) is a chemical compound with molecular formula C8H5Cl5 and molecular weight 275.88 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-ethylbenzene
Also Known As: Athylpentachlorbenzol, PENTACHLOROETHYLBENZENE, ethylpentachlorobenzene, pentachloroethyl-benzene, 1,2,3,4,5-pentachloro-6-ethylbenzene
| Molecular Formula | C8H5Cl5 |
|---|---|
| Molecular Weight | 275.88 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 277.88043 |
| Heavy Atoms | 13 |
| Complexity | 158.0 |
Chemical Identifiers
| CAS Number | 606-07-5 |
|---|---|
| SMILES | CCC1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl |
| InChIKey | JBLPFPMLHWDSFR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pentachloroethylbenzene (CAS 606-07-5), with molecular formula C8H5Cl5 and molecular weight 275.88 g/mol. IUPAC: 1,2,3,4,5-pentachloro-6-ethylbenzene.
Chemical Property Profile of Pentachloroethylbenzene
Property Insights of Pentachloroethylbenzene
The XLogP value of 5.9 indicates that Pentachloroethylbenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Pentachloroethylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pentachloroethylbenzene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pentachloroethylbenzene?
The CAS number of Pentachloroethylbenzene is 606-07-5.
What is the molecular formula of Pentachloroethylbenzene?
The molecular formula of Pentachloroethylbenzene is C8H5Cl5.
What is the molecular weight of Pentachloroethylbenzene?
The molecular weight of Pentachloroethylbenzene is 275.88 g/mol.
Where can I buy Pentachloroethylbenzene?
You can request a quote for Pentachloroethylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pentachloroethylbenzene?
Yes, KEHONG BIO provides custom synthesis services for Pentachloroethylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.