![6-Fluoro-3-methyl-2-oxo-2,3-dihydrobenzo[d]oxazole-7-carboxylic acid structure](/static/products/4452/445219-44-3.webp)
6-Fluoro-3-methyl-2-oxo-2,3-dihydrobenzo[d]oxazole-7-carboxylic acid
TL;DR: 6-Fluoro-3-methyl-2-oxo-2,3-dihydrobenzo[d]oxazole-7-carboxylic acid (CAS 445219-44-3) is a chemical compound with molecular formula C9H6FNO4 and molecular weight 211.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-fluoro-3-methyl-2-oxo-1,3-benzoxazole-7-carboxylic acid
Also Known As: 6-fluoro-3-methyl-2-oxo-1,3-benzoxazole-7-carboxylic acid, 6-Fluoro-3-methyl-2-oxo-2,3-dihydrobenzo[d]oxazole-7-carboxylic acid, 6-fluoro-3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-7-carboxylic acid
| Molecular Formula | C9H6FNO4 |
|---|---|
| Molecular Weight | 211.03 g/mol |
| LogP | 0.9688 |
| Topological Polar Surface Area | 72.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 211.02809 |
| Heavy Atoms | 15 |
| Complexity | 610.33527 |
Chemical Identifiers
| CAS Number | 445219-44-3 |
|---|---|
| SMILES | CN1C2=C(C(=C(C=C2)F)C(=O)O)OC1=O |
Product Overview
6-Fluoro-3-methyl-2-oxo-2,3-dihydrobenzo[d]oxazole-7-carboxylic acid (CAS 445219-44-3), with molecular formula C9H6FNO4 and molecular weight 211.03 g/mol. IUPAC: 6-fluoro-3-methyl-2-oxo-1,3-benzoxazole-7-carboxylic acid.
Chemical Property Profile of 6-Fluoro-3-methyl-2-oxo-2,3-dihydrobenzo[d]oxazole-7-carboxylic acid
Property Insights of 6-Fluoro-3-methyl-2-oxo-2,3-dihydrobenzo[d]oxazole-7-carboxylic acid
The XLogP value of 0.9688 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Fluoro-3-methyl-2-oxo-2,3-dihydrobenzo[d]oxazole-7-carboxylic acid. The TPSA of 72.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Fluoro-3-methyl-2-oxo-2,3-dihydrobenzo[d]oxazole-7-carboxylic acid. Following Lipinski's Rule of Five, 6-Fluoro-3-methyl-2-oxo-2,3-dihydrobenzo[d]oxazole-7-carboxylic acid 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
Frequently Asked Questions
What is the CAS number of 6-Fluoro-3-methyl-2-oxo-2,3-dihydrobenzo[d]oxazole-7-carboxylic acid?
The CAS number of 6-Fluoro-3-methyl-2-oxo-2,3-dihydrobenzo[d]oxazole-7-carboxylic acid is 445219-44-3.
What is the molecular formula of 6-Fluoro-3-methyl-2-oxo-2,3-dihydrobenzo[d]oxazole-7-carboxylic acid?
The molecular formula of 6-Fluoro-3-methyl-2-oxo-2,3-dihydrobenzo[d]oxazole-7-carboxylic acid is C9H6FNO4.
What is the molecular weight of 6-Fluoro-3-methyl-2-oxo-2,3-dihydrobenzo[d]oxazole-7-carboxylic acid?
The molecular weight of 6-Fluoro-3-methyl-2-oxo-2,3-dihydrobenzo[d]oxazole-7-carboxylic acid is 211.03 g/mol.
Where can I buy 6-Fluoro-3-methyl-2-oxo-2,3-dihydrobenzo[d]oxazole-7-carboxylic acid?
You can request a quote for 6-Fluoro-3-methyl-2-oxo-2,3-dihydrobenzo[d]oxazole-7-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Fluoro-3-methyl-2-oxo-2,3-dihydrobenzo[d]oxazole-7-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-Fluoro-3-methyl-2-oxo-2,3-dihydrobenzo[d]oxazole-7-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.