Dichloralphenazone
TL;DR: Dichloralphenazone (CAS 480-30-8) is a chemical compound with molecular formula C15H18Cl6N2O5 and molecular weight 515.9347 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,5-dimethyl-2-phenylpyrazol-3-one;bis(2,2,2-trichloroethane-1,1-diol)
Also Known As: Dichloralphenazone, Dichloralantipyrine, Kloralfenazon, Dormuphar, Ibiodorm
Application Areas
Top 5 of 15 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C15H18Cl6N2O5 |
| Molecular Weight | 515.9347 g/mol |
| XLogP | 2.82 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 517.93176 Da |
| Heavy Atoms | 28 |
| Complexity | 323.0 |
| Melting Point | 68 |
| SMILES | CC1=CC(=O)N(N1C)C2=CC=CC=C2.C(C(Cl)(Cl)Cl)(O)O.C(C(Cl)(Cl)Cl)(O)O |
| InChIKey | ATKXDQOHNICLQW-UHFFFAOYSA-N |
Product Description
Applications: Dichloralphenazone is used in pharmaceutical synthesis routes and API production, as well as complex organic molecule assembly across discovery and process chemistry. 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).
A pharmaceutical intermediate supplied by CoreyChem, Dichloralphenazone (CAS 480-30-8) has the molecular formula C15H18Cl6N2O5 and a molecular weight of 515.93 g/mol. Synonyms include Dichloralphenazone and Dichloralantipyrine.
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 Dichloralphenazone
Property Insights of Dichloralphenazone
The XLogP value of 2.82 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dichloralphenazone. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Dichloralphenazone. Following Lipinski's Rule of Five, Dichloralphenazone has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Dichloralphenazone?
The CAS number of Dichloralphenazone is 480-30-8.
What is the molecular formula of Dichloralphenazone?
The molecular formula of Dichloralphenazone is C15H18Cl6N2O5.
What is the molecular weight of Dichloralphenazone?
The molecular weight of Dichloralphenazone is 515.9347 g/mol.
What are the applications of Dichloralphenazone?
Dichloralphenazone is used in pharmaceutical synthesis routes and API production, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy Dichloralphenazone?
You can request a quote for Dichloralphenazone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dichloralphenazone?
Yes, CoreyChem provides custom synthesis services for Dichloralphenazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.