Chlorzoxazone
TL;DR: Chlorzoxazone (CAS 95-25-0) is a chemical compound with molecular formula C7H4ClNO2 and molecular weight 168.99306 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-chloro-3H-1,3-benzoxazol-2-one
Also Known As: chlorzoxazone, Paraflex, Chloroxazone, Chlorzoxazon, Myoflexine
Application Areas
Top 5 of 18 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H4ClNO2 |
| Molecular Weight | 168.99306 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 168.99306 Da |
| Heavy Atoms | 11 |
| Complexity | 185.0 |
| Melting Point | 191-191.5 |
| Solubility | 1000 |
| SMILES | C1=CC2=C(C=C1Cl)NC(=O)O2 |
| InChIKey | TZFWDZFKRBELIQ-UHFFFAOYSA-N |
Product Description
Applications: Chlorzoxazone is used in pharmaceutical synthesis routes and API production, 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).
A pharmaceutical intermediate supplied by CoreyChem, Chlorzoxazone (CAS 95-25-0) has the molecular formula C7H4ClNO2 and a molecular weight of 168.99 g/mol. Reported properties include a solubility: 1000. Synonyms include chlorzoxazone and Paraflex.
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 Chlorzoxazone
Property Insights of Chlorzoxazone
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Chlorzoxazone. With a topological polar surface area (TPSA) of 38.3 Ų, Chlorzoxazone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Chlorzoxazone has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Chlorzoxazone?
The CAS number of Chlorzoxazone is 95-25-0.
What is the molecular formula of Chlorzoxazone?
The molecular formula of Chlorzoxazone is C7H4ClNO2.
What is the molecular weight of Chlorzoxazone?
The molecular weight of Chlorzoxazone is 168.99306 g/mol.
What are the applications of Chlorzoxazone?
Chlorzoxazone is used in pharmaceutical synthesis routes and API production, 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 Chlorzoxazone?
You can request a quote for Chlorzoxazone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Chlorzoxazone?
Yes, CoreyChem provides custom synthesis services for Chlorzoxazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.