Zoxazolamine
TL;DR: Zoxazolamine (CAS 61-80-3) is a chemical compound with molecular formula C7H5ClN2O and molecular weight 168.00903 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-chloro-1,3-benzoxazol-2-amine
Also Known As: Zoxazolamine, 2-Amino-5-chlorobenzoxazole, Flexin, Contrazole, Deflexol
Application Areas
Top 5 of 15 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H5ClN2O |
| Molecular Weight | 168.00903 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 52.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 168.00903 Da |
| Heavy Atoms | 11 |
| Complexity | 155.0 |
| SMILES | C1=CC2=C(C=C1Cl)N=C(O2)N |
| InChIKey | YGCODSQDUUUKIV-UHFFFAOYSA-N |
Product Description
Applications: Zoxazolamine 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. CoreyChem supplies Zoxazolamine (CAS 61-80-3) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A pharmaceutical intermediate supplied by CoreyChem, Zoxazolamine (CAS 61-80-3) has the molecular formula C7H5ClN2O and a molecular weight of 168.01 g/mol. It is also known as Zoxazolamine and 2-Amino-5-chlorobenzoxazole.
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 Zoxazolamine
Property Insights of Zoxazolamine
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Zoxazolamine. With a topological polar surface area (TPSA) of 52.1 Ų, Zoxazolamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Zoxazolamine has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Zoxazolamine?
The CAS number of Zoxazolamine is 61-80-3.
What is the molecular formula of Zoxazolamine?
The molecular formula of Zoxazolamine is C7H5ClN2O.
What is the molecular weight of Zoxazolamine?
The molecular weight of Zoxazolamine is 168.00903 g/mol.
What are the applications of Zoxazolamine?
Zoxazolamine 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. CoreyChem supplies Zoxazolamine (CAS 61-80-3) with custom...
Where can I buy Zoxazolamine?
You can request a quote for Zoxazolamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Zoxazolamine?
Yes, CoreyChem provides custom synthesis services for Zoxazolamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.