1,2,3,4,5-Pentachloro-6-(chlorosulfanyl)benzene
TL;DR: 1,2,3,4,5-Pentachloro-6-(chlorosulfanyl)benzene (CAS 22738-16-5) is a chemical compound with molecular formula C6Cl6S and molecular weight 313.79 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,3,4,5,6-pentachlorophenyl) thiohypochlorite
Also Known As: Pentachlorophenylthio chloride, pentachlorobenzene sulfenyl chloride, pentachlorobenzenesulfenyl chloride, 1,2,3,4,5-pentachloro-6-(chlorosulfanyl)benzene, KST-1B1867
| Molecular Formula | C6Cl6S |
|---|---|
| Molecular Weight | 313.79 g/mol |
| LogP | 6.0 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 313.7852 |
| Heavy Atoms | 13 |
| Complexity | 163.0 |
Chemical Identifiers
| CAS Number | 22738-16-5 |
|---|---|
| SMILES | C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)SCl |
| InChIKey | YVDBISQMWKWRBX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2,3,4,5-Pentachloro-6-(chlorosulfanyl)benzene (CAS 22738-16-5), with molecular formula C6Cl6S and molecular weight 313.79 g/mol. IUPAC: (2,3,4,5,6-pentachlorophenyl) thiohypochlorite.
Chemical Property Profile of 1,2,3,4,5-Pentachloro-6-(chlorosulfanyl)benzene
Property Insights of 1,2,3,4,5-Pentachloro-6-(chlorosulfanyl)benzene
The XLogP value of 6.0 indicates that 1,2,3,4,5-Pentachloro-6-(chlorosulfanyl)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.3 Ų, 1,2,3,4,5-Pentachloro-6-(chlorosulfanyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,3,4,5-Pentachloro-6-(chlorosulfanyl)benzene 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 1,2,3,4,5-Pentachloro-6-(chlorosulfanyl)benzene?
The CAS number of 1,2,3,4,5-Pentachloro-6-(chlorosulfanyl)benzene is 22738-16-5.
What is the molecular formula of 1,2,3,4,5-Pentachloro-6-(chlorosulfanyl)benzene?
The molecular formula of 1,2,3,4,5-Pentachloro-6-(chlorosulfanyl)benzene is C6Cl6S.
What is the molecular weight of 1,2,3,4,5-Pentachloro-6-(chlorosulfanyl)benzene?
The molecular weight of 1,2,3,4,5-Pentachloro-6-(chlorosulfanyl)benzene is 313.79 g/mol.
Where can I buy 1,2,3,4,5-Pentachloro-6-(chlorosulfanyl)benzene?
You can request a quote for 1,2,3,4,5-Pentachloro-6-(chlorosulfanyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3,4,5-Pentachloro-6-(chlorosulfanyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3,4,5-Pentachloro-6-(chlorosulfanyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.