2,4-Dichlorothioanisole
TL;DR: 2,4-Dichlorothioanisole (CAS 65909-82-2) is a chemical compound with molecular formula C7H6Cl2S and molecular weight 191.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dichloro-1-methylsulfanylbenzene
Also Known As: 2,4-Dichlorothioanisole, (2,4-Dichlorophenyl)(methyl)sulfane, 2.4-Dichlor-thioanisol, 2,4-dichloro-1-methylsulfanylbenzene, 2,4-Dichlorobenzylmercaptan
| Molecular Formula | C7H6Cl2S |
|---|---|
| Molecular Weight | 191.96 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 191.95673 |
| Heavy Atoms | 10 |
| Complexity | 108.0 |
Chemical Identifiers
| CAS Number | 65909-82-2 |
|---|---|
| SMILES | CSC1=C(C=C(C=C1)Cl)Cl |
| InChIKey | NPJIKKXEAPKKFT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4-Dichlorothioanisole (CAS 65909-82-2), with molecular formula C7H6Cl2S and molecular weight 191.96 g/mol. IUPAC: 2,4-dichloro-1-methylsulfanylbenzene.
Chemical Property Profile of 2,4-Dichlorothioanisole
Property Insights of 2,4-Dichlorothioanisole
The XLogP value of 3.7 indicates that 2,4-Dichlorothioanisole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.3 Ų, 2,4-Dichlorothioanisole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Dichlorothioanisole has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,4-Dichlorothioanisole?
The CAS number of 2,4-Dichlorothioanisole is 65909-82-2.
What is the molecular formula of 2,4-Dichlorothioanisole?
The molecular formula of 2,4-Dichlorothioanisole is C7H6Cl2S.
What is the molecular weight of 2,4-Dichlorothioanisole?
The molecular weight of 2,4-Dichlorothioanisole is 191.96 g/mol.
Where can I buy 2,4-Dichlorothioanisole?
You can request a quote for 2,4-Dichlorothioanisole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dichlorothioanisole?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dichlorothioanisole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.