![2-Methylbenzo[f][1,3]benzoxazole-4,9-dione structure](/static/products/633/63351-48-4.png)
2-Methylbenzo[f][1,3]benzoxazole-4,9-dione
TL;DR: 2-Methylbenzo[f][1,3]benzoxazole-4,9-dione (CAS 63351-48-4) is a chemical compound with molecular formula C12H7NO3 and molecular weight 213.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylbenzo[f][1,3]benzoxazole-4,9-dione
Also Known As: 2-methyl-naphthoxazole-4,9-quinone, 2-Methylnaphth[2,3-d]oxazole-4,9-dione, 2-methylbenzo[f][1,3]benzoxazole-4,9-dione, 2-methyl-4H,9H-naphtho[2,3-d][1,3]oxazole-4,9-dione
| Molecular Formula | C12H7NO3 |
|---|---|
| Molecular Weight | 213.04 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 60.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 213.04259 |
| Heavy Atoms | 16 |
| Complexity | 341.0 |
Chemical Identifiers
| CAS Number | 63351-48-4 |
|---|---|
| SMILES | CC1=NC2=C(O1)C(=O)C3=CC=CC=C3C2=O |
| InChIKey | LITUYNXDDUJZRJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Methylbenzo[f][1,3]benzoxazole-4,9-dione (CAS 63351-48-4), with molecular formula C12H7NO3 and molecular weight 213.04 g/mol. IUPAC: 2-methylbenzo[f][1,3]benzoxazole-4,9-dione.
Chemical Property Profile of 2-Methylbenzo[f][1,3]benzoxazole-4,9-dione
Property Insights of 2-Methylbenzo[f][1,3]benzoxazole-4,9-dione
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methylbenzo[f][1,3]benzoxazole-4,9-dione. The TPSA of 60.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methylbenzo[f][1,3]benzoxazole-4,9-dione. Following Lipinski's Rule of Five, 2-Methylbenzo[f][1,3]benzoxazole-4,9-dione 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
Frequently Asked Questions
What is the CAS number of 2-Methylbenzo[f][1,3]benzoxazole-4,9-dione?
The CAS number of 2-Methylbenzo[f][1,3]benzoxazole-4,9-dione is 63351-48-4.
What is the molecular formula of 2-Methylbenzo[f][1,3]benzoxazole-4,9-dione?
The molecular formula of 2-Methylbenzo[f][1,3]benzoxazole-4,9-dione is C12H7NO3.
What is the molecular weight of 2-Methylbenzo[f][1,3]benzoxazole-4,9-dione?
The molecular weight of 2-Methylbenzo[f][1,3]benzoxazole-4,9-dione is 213.04 g/mol.
Where can I buy 2-Methylbenzo[f][1,3]benzoxazole-4,9-dione?
You can request a quote for 2-Methylbenzo[f][1,3]benzoxazole-4,9-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methylbenzo[f][1,3]benzoxazole-4,9-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-Methylbenzo[f][1,3]benzoxazole-4,9-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.