Chlorbenside
TL;DR: Chlorbenside (CAS 103-17-3) is a chemical compound with molecular formula C13H10Cl2S and molecular weight 267.98804 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-chloro-4-[(4-chlorophenyl)methylsulfanyl]benzene
Also Known As: CHLORBENSIDE, Chlorbensid, Chlorsulphacide, Mitox, Chloroparacide
Application Areas
Top 5 of 20 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H10Cl2S |
| Molecular Weight | 267.98804 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 267.98804 Da |
| 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/4 °C |
| Vapor Pressure | 0.0000178 [mmHg] |
| Solubility | About 2.9 percent in ethanol; 5-7.5 percent in kerosene; soluble in acetone, benzene, toluene, xylene, petroleum ether. |
| SMILES | C1=CC(=CC=C1CSC2=CC=C(C=C2)Cl)Cl |
| InChIKey | ZHLKXBJTJHRTTE-UHFFFAOYSA-N |
Product Description
Applications: Chlorbenside is used in agrochemical development, including crop protection agent synthesis, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Chlorbenside (CAS 103-17-3) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A agrochemical intermediate supplied by CoreyChem, Chlorbenside (CAS 103-17-3) has the molecular formula C13H10Cl2S and a molecular weight of 267.99 g/mol. Reported properties include a density of 1.4210 @ 25 °C/4 °C g/cm³, a solubility: About 2.9 percent in ethanol; 5-7.5 percent in kerosene; soluble in acetone, benzene, toluene, xylene, petroleum ether. It is also known as CHLORBENSIDE and Chlorbensid.
CoreyChem provides it with COA documentation, and custom synthesis from milligram to multi-kilogram scales is available on request. Request a quotation with your required quantity and purity for current lead time and pricing.
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
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 267.98804 g/mol.
What are the applications of Chlorbenside?
Chlorbenside is used in agrochemical development, including crop protection agent synthesis, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Chlorbenside (CAS...
Where can I buy Chlorbenside?
You can request a quote for Chlorbenside directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Chlorbenside?
Yes, CoreyChem provides custom synthesis services for Chlorbenside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.