![6-fluoro-2-methyl-4H-benzo[d][1,3]oxazin-4-one structure](/static/products/3882/3882-57-3.webp)
6-fluoro-2-methyl-4H-benzo[d][1,3]oxazin-4-one
TL;DR: 6-fluoro-2-methyl-4H-benzo[d][1,3]oxazin-4-one (CAS 3882-57-3) is a chemical compound with molecular formula C9H6FNO2 and molecular weight 179.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-fluoro-2-methyl-3,1-benzoxazin-4-one
Also Known As: 6-fluoro-2-methyl-4H-benzo[d][1,3]oxazin-4-one, 6-fluoro-2-methyl-3,1-benzoxazin-4-one, 6-fluor-2-methyl-4h-3,1-benzoxazin-4-on, 6-fluoro-2-methyl-4h-3,1-benzoxazin-4-one, 2-Methyl-6-fluoro-4-oxo-3,1-benzoxazin
| Molecular Formula | C9H6FNO2 |
|---|---|
| Molecular Weight | 179.04 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 179.03825 |
| Heavy Atoms | 13 |
| Complexity | 264.0 |
Chemical Identifiers
| CAS Number | 3882-57-3 |
|---|---|
| SMILES | CC1=NC2=C(C=C(C=C2)F)C(=O)O1 |
| InChIKey | REAWYHMDDZZSSJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-fluoro-2-methyl-4H-benzo[d][1,3]oxazin-4-one (CAS 3882-57-3), with molecular formula C9H6FNO2 and molecular weight 179.04 g/mol. IUPAC: 6-fluoro-2-methyl-3,1-benzoxazin-4-one.
Chemical Property Profile of 6-fluoro-2-methyl-4H-benzo[d][1,3]oxazin-4-one
Property Insights of 6-fluoro-2-methyl-4H-benzo[d][1,3]oxazin-4-one
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-fluoro-2-methyl-4H-benzo[d][1,3]oxazin-4-one. With a topological polar surface area (TPSA) of 38.7 Ų, 6-fluoro-2-methyl-4H-benzo[d][1,3]oxazin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-fluoro-2-methyl-4H-benzo[d][1,3]oxazin-4-one 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 6-fluoro-2-methyl-4H-benzo[d][1,3]oxazin-4-one?
The CAS number of 6-fluoro-2-methyl-4H-benzo[d][1,3]oxazin-4-one is 3882-57-3.
What is the molecular formula of 6-fluoro-2-methyl-4H-benzo[d][1,3]oxazin-4-one?
The molecular formula of 6-fluoro-2-methyl-4H-benzo[d][1,3]oxazin-4-one is C9H6FNO2.
What is the molecular weight of 6-fluoro-2-methyl-4H-benzo[d][1,3]oxazin-4-one?
The molecular weight of 6-fluoro-2-methyl-4H-benzo[d][1,3]oxazin-4-one is 179.04 g/mol.
Where can I buy 6-fluoro-2-methyl-4H-benzo[d][1,3]oxazin-4-one?
You can request a quote for 6-fluoro-2-methyl-4H-benzo[d][1,3]oxazin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-fluoro-2-methyl-4H-benzo[d][1,3]oxazin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 6-fluoro-2-methyl-4H-benzo[d][1,3]oxazin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.