Dacthal
TL;DR: Dacthal (CAS 1861-32-1) is a chemical compound with molecular formula C10H6Cl4O4 and molecular weight 329.902 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate
Also Known As: Chlorthal-dimethyl, dacthal, Dacthalor, Tetral, Fatal
Application Areas
Top 5 of 14 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H6Cl4O4 |
| Molecular Weight | 329.902 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 331.89908 Da |
| Heavy Atoms | 18 |
| Complexity | 290.0 |
| Melting Point | 155-156 °C |
| Vapor Pressure | 0.0000025 [mmHg] |
| Solubility | LESS THAN 5% IN WATER; GREATER THAN 5% IN CYCLOHEXANONE, ACETONE, XYLENE |
| SMILES | COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl |
| InChIKey | NPOJQCVWMSKXDN-UHFFFAOYSA-N |
Product Description
Applications: Dacthal 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. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Dacthal is a agrochemical intermediate identified by CAS number 1861-32-1 and the molecular formula C10H6Cl4O4 and a molecular weight of 329.9 g/mol. Physically, the compound has a solubility: LESS THAN 5% IN WATER; GREATER THAN 5% IN CYCLOHEXANONE, ACETONE, XYLENE. Synonyms include Chlorthal-dimethyl and dacthal.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Dacthal
Property Insights of Dacthal
The XLogP value of 4.4 indicates that Dacthal is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Dacthal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dacthal has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Dacthal?
The CAS number of Dacthal is 1861-32-1.
What is the molecular formula of Dacthal?
The molecular formula of Dacthal is C10H6Cl4O4.
What is the molecular weight of Dacthal?
The molecular weight of Dacthal is 329.902 g/mol.
What are the applications of Dacthal?
Dacthal 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. Available from CoreyChem as both catalog item and...
Where can I buy Dacthal?
You can request a quote for Dacthal directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dacthal?
Yes, CoreyChem provides custom synthesis services for Dacthal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.