2,3-Dichloro-5,6-dicyano-1,4-benzoquinone
TL;DR: 2,3-Dichloro-5,6-dicyano-1,4-benzoquinone (CAS 84-58-2) is a chemical compound with molecular formula C8Cl2N2O2 and molecular weight 225.93369 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4,5-dichloro-3,6-dioxocyclohexa-1,4-diene-1,2-dicarbonitrile
Also Known As: 2,3-Dichloro-5,6-dicyano-1,4-benzoquinone, Dichlorodicyanoquinone, Dichlorodicyanobenzoquinone, Dichlorodicyano-p-benzoquinone, 2,3-Dichloro-5,6-dicyanobenzoquinone
Application Areas
Top 5 of 20 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8Cl2N2O2 |
| Molecular Weight | 225.93369 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 81.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 225.93369 Da |
| Heavy Atoms | 14 |
| Complexity | 464.0 |
| SMILES | C(#N)C1=C(C(=O)C(=C(C1=O)Cl)Cl)C#N |
| InChIKey | HZNVUJQVZSTENZ-UHFFFAOYSA-N |
Product Description
Applications: 2,3-Dichloro-5,6-dicyano-1,4-benzoquinone is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. 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).
2,3-Dichloro-5,6-dicyano-1,4-benzoquinone is a heterocyclic building block identified by CAS number 84-58-2 and the molecular formula C8Cl2N2O2 and a molecular weight of 225.93 g/mol. Synonyms include 2,3-Dichloro-5,6-dicyano-1,4-benzoquinone and Dichlorodicyanoquinone.
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 2,3-Dichloro-5,6-dicyano-1,4-benzoquinone
Property Insights of 2,3-Dichloro-5,6-dicyano-1,4-benzoquinone
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-Dichloro-5,6-dicyano-1,4-benzoquinone. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,3-Dichloro-5,6-dicyano-1,4-benzoquinone. Following Lipinski's Rule of Five, 2,3-Dichloro-5,6-dicyano-1,4-benzoquinone 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 2,3-Dichloro-5,6-dicyano-1,4-benzoquinone?
The CAS number of 2,3-Dichloro-5,6-dicyano-1,4-benzoquinone is 84-58-2.
What is the molecular formula of 2,3-Dichloro-5,6-dicyano-1,4-benzoquinone?
The molecular formula of 2,3-Dichloro-5,6-dicyano-1,4-benzoquinone is C8Cl2N2O2.
What is the molecular weight of 2,3-Dichloro-5,6-dicyano-1,4-benzoquinone?
The molecular weight of 2,3-Dichloro-5,6-dicyano-1,4-benzoquinone is 225.93369 g/mol.
What are the applications of 2,3-Dichloro-5,6-dicyano-1,4-benzoquinone?
2,3-Dichloro-5,6-dicyano-1,4-benzoquinone is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both...
Where can I buy 2,3-Dichloro-5,6-dicyano-1,4-benzoquinone?
You can request a quote for 2,3-Dichloro-5,6-dicyano-1,4-benzoquinone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,3-Dichloro-5,6-dicyano-1,4-benzoquinone?
Yes, CoreyChem provides custom synthesis services for 2,3-Dichloro-5,6-dicyano-1,4-benzoquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.