1-Chloro-4-(1,1,2,2,2-pentachloroethyl)benzene
TL;DR: 1-Chloro-4-(1,1,2,2,2-pentachloroethyl)benzene (CAS 830-39-7) is a chemical compound with molecular formula C8H4Cl6 and molecular weight 309.84 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-4-(1,1,2,2,2-pentachloroethyl)benzene
Also Known As: 1-Chloro-4-(1,1,2,2,2-pentachloroethyl)benzene, 1-Chloro-4-(pentachloroethyl)benzene, 1-Chloro-4-(1,1,2,2,2-pentachloroethyl)benzene #, RefChem:229411
| Molecular Formula | C8H4Cl6 |
|---|---|
| Molecular Weight | 309.84 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 309.84442 |
| Heavy Atoms | 14 |
| Complexity | 188.0 |
Chemical Identifiers
| CAS Number | 830-39-7 |
|---|---|
| SMILES | C1=CC(=CC=C1C(C(Cl)(Cl)Cl)(Cl)Cl)Cl |
| InChIKey | SPCOQYQEUMJGBW-UHFFFAOYSA-N |
Product Overview
1-Chloro-4-(1,1,2,2,2-pentachloroethyl)benzene (CAS 830-39-7), with molecular formula C8H4Cl6 and molecular weight 309.84 g/mol. IUPAC: 1-chloro-4-(1,1,2,2,2-pentachloroethyl)benzene.
Chemical Property Profile of 1-Chloro-4-(1,1,2,2,2-pentachloroethyl)benzene
Property Insights of 1-Chloro-4-(1,1,2,2,2-pentachloroethyl)benzene
The XLogP value of 5.3 indicates that 1-Chloro-4-(1,1,2,2,2-pentachloroethyl)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1-Chloro-4-(1,1,2,2,2-pentachloroethyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chloro-4-(1,1,2,2,2-pentachloroethyl)benzene 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 1-Chloro-4-(1,1,2,2,2-pentachloroethyl)benzene?
The CAS number of 1-Chloro-4-(1,1,2,2,2-pentachloroethyl)benzene is 830-39-7.
What is the molecular formula of 1-Chloro-4-(1,1,2,2,2-pentachloroethyl)benzene?
The molecular formula of 1-Chloro-4-(1,1,2,2,2-pentachloroethyl)benzene is C8H4Cl6.
What is the molecular weight of 1-Chloro-4-(1,1,2,2,2-pentachloroethyl)benzene?
The molecular weight of 1-Chloro-4-(1,1,2,2,2-pentachloroethyl)benzene is 309.84 g/mol.
Where can I buy 1-Chloro-4-(1,1,2,2,2-pentachloroethyl)benzene?
You can request a quote for 1-Chloro-4-(1,1,2,2,2-pentachloroethyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Chloro-4-(1,1,2,2,2-pentachloroethyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Chloro-4-(1,1,2,2,2-pentachloroethyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.