Chlorbenside
TL;DR: Chlorbenside (CAS 103-17-3) is a chemical compound with molecular formula C13H10Cl2S and molecular weight 267.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-4-[(4-chlorophenyl)methylsulfanyl]benzene
Also Known As: CHLORBENSIDE, Chlorbensid, Chlorsulphacide, Mitox, Chloroparacide
| Molecular Formula | C13H10Cl2S |
|---|---|
| Molecular Weight | 267.99 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 267.98804 |
| Heavy Atoms | 16 |
| Complexity | 194.0 |
| Melting Point | 75-76 °C |
| Boiling Point | 83-84 °C at 0.0024 mm Hg |
| Density | 1.4210 @ 25 °C |
| Solubility | About 2.9 percent in ethanol; 5-7.5 percent in kerosene; soluble in acetone, benzene, toluene, xylene, petroleum ether. |
| Vapor Pressure | 0.0000178 [mmHg] |
Chemical Identifiers
| CAS Number | 103-17-3 |
|---|---|
| SMILES | C1=CC(=CC=C1CSC2=CC=C(C=C2)Cl)Cl |
| InChIKey | ZHLKXBJTJHRTTE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Chlorbenside (CAS 103-17-3), with molecular formula C13H10Cl2S and molecular weight 267.99 g/mol. IUPAC: 1-chloro-4-[(4-chlorophenyl)methylsulfanyl]benzene.
Chemical Property Profile of Chlorbenside
Property Insights of Chlorbenside
The XLogP value of 5.2 indicates that Chlorbenside is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.3 Ų, Chlorbenside exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Chlorbenside 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 Chlorbenside?
The CAS number of Chlorbenside is 103-17-3.
What is the molecular formula of Chlorbenside?
The molecular formula of Chlorbenside is C13H10Cl2S.
What is the molecular weight of Chlorbenside?
The molecular weight of Chlorbenside is 267.99 g/mol.
Where can I buy Chlorbenside?
You can request a quote for Chlorbenside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chlorbenside?
Yes, KEHONG BIO provides custom synthesis services for Chlorbenside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.