1,2,3,4-Tetrachloro-5-(phenylsulfanyl)benzene
TL;DR: 1,2,3,4-Tetrachloro-5-(phenylsulfanyl)benzene (CAS 6341-33-9) is a chemical compound with molecular formula C12H6Cl4S and molecular weight 321.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,4-tetrachloro-5-phenylsulfanylbenzene
Also Known As: 3-s-butylpyridine, 1,2,3,4-tetrachloro-5-(phenylsulfanyl)benzene, KST-1B6708, 1,2,3,4-tetrachloro-5-phenylsulfanylbenzene, 1,2,3,4-tetrachloro-5-phenylsulfanyl-benzene
| Molecular Formula | C12H6Cl4S |
|---|---|
| Molecular Weight | 321.89 g/mol |
| LogP | 6.5 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 321.89444 |
| Heavy Atoms | 17 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 6341-33-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)SC2=CC(=C(C(=C2Cl)Cl)Cl)Cl |
| InChIKey | AHCGIRARGJAIPX-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-Tetrachloro-5-(phenylsulfanyl)benzene (CAS 6341-33-9), with molecular formula C12H6Cl4S and molecular weight 321.89 g/mol. IUPAC: 1,2,3,4-tetrachloro-5-phenylsulfanylbenzene.
Chemical Property Profile of 1,2,3,4-Tetrachloro-5-(phenylsulfanyl)benzene
Property Insights of 1,2,3,4-Tetrachloro-5-(phenylsulfanyl)benzene
The XLogP value of 6.5 indicates that 1,2,3,4-Tetrachloro-5-(phenylsulfanyl)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-Tetrachloro-5-(phenylsulfanyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,3,4-Tetrachloro-5-(phenylsulfanyl)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-Tetrachloro-5-(phenylsulfanyl)benzene?
The CAS number of 1,2,3,4-Tetrachloro-5-(phenylsulfanyl)benzene is 6341-33-9.
What is the molecular formula of 1,2,3,4-Tetrachloro-5-(phenylsulfanyl)benzene?
The molecular formula of 1,2,3,4-Tetrachloro-5-(phenylsulfanyl)benzene is C12H6Cl4S.
What is the molecular weight of 1,2,3,4-Tetrachloro-5-(phenylsulfanyl)benzene?
The molecular weight of 1,2,3,4-Tetrachloro-5-(phenylsulfanyl)benzene is 321.89 g/mol.
Where can I buy 1,2,3,4-Tetrachloro-5-(phenylsulfanyl)benzene?
You can request a quote for 1,2,3,4-Tetrachloro-5-(phenylsulfanyl)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-Tetrachloro-5-(phenylsulfanyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3,4-Tetrachloro-5-(phenylsulfanyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.