Coixol
TL;DR: Coixol (CAS 532-91-2) is a chemical compound with molecular formula C8H7NO3 and molecular weight 165.04259 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-methoxy-3H-1,3-benzoxazol-2-one
Also Known As: Coixol, 6-Methoxy-2-benzoxazolinone, MBOA, 6-Methoxybenzoxazolinone, 6-METHOXYBENZO[D]OXAZOL-2(3H)-ONE
Application Areas
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H7NO3 |
| Molecular Weight | 165.04259 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 47.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 165.04259 Da |
| Heavy Atoms | 12 |
| Complexity | 195.0 |
| Melting Point | 160 - 161 °C |
| SMILES | COC1=CC2=C(C=C1)NC(=O)O2 |
| InChIKey | MKMCJLMBVKHUMS-UHFFFAOYSA-N |
Product Description
Applications: Coixol 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 Coixol (CAS 532-91-2) 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, Coixol (CAS 532-91-2) has the molecular formula C8H7NO3 and a molecular weight of 165.04 g/mol. It is also known as Coixol and 6-Methoxy-2-benzoxazolinone.
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 Coixol
Property Insights of Coixol
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Coixol. With a topological polar surface area (TPSA) of 47.6 Ų, Coixol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Coixol 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 Coixol?
The CAS number of Coixol is 532-91-2.
What is the molecular formula of Coixol?
The molecular formula of Coixol is C8H7NO3.
What is the molecular weight of Coixol?
The molecular weight of Coixol is 165.04259 g/mol.
What are the applications of Coixol?
Coixol 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 Coixol (CAS 532-91-2) with custom synthesis...
Where can I buy Coixol?
You can request a quote for Coixol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Coixol?
Yes, CoreyChem provides custom synthesis services for Coixol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.