2-Ethoxy-6-methyl-3,1-benzoxazin-4-one
TL;DR: 2-Ethoxy-6-methyl-3,1-benzoxazin-4-one (CAS 135498-43-0) is a chemical compound with molecular formula C11H11NO3 and molecular weight 205.0739 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-ethoxy-6-methyl-3,1-benzoxazin-4-one
Also Known As: Cetilistat Impurity 3, Cetilistat Impurity 9, Cetilistat Impurity F, Maybridge3_005882, 2-ethoxy-6-methyl-3,1-benzoxazin-4-one
Technical Specifications
| Molecular Formula | C11H11NO3 |
| Molecular Weight | 205.0739 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 47.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 205.0739 Da |
| Heavy Atoms | 15 |
| Complexity | 288.0 |
| SMILES | CCOC1=NC2=C(C=C(C=C2)C)C(=O)O1 |
| InChIKey | ZKWXJEXMJCTFIZ-UHFFFAOYSA-N |
Chemical Property Profile of 2-Ethoxy-6-methyl-3,1-benzoxazin-4-one
Property Insights of 2-Ethoxy-6-methyl-3,1-benzoxazin-4-one
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Ethoxy-6-methyl-3,1-benzoxazin-4-one. With a topological polar surface area (TPSA) of 47.9 Ų, 2-Ethoxy-6-methyl-3,1-benzoxazin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Ethoxy-6-methyl-3,1-benzoxazin-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
What is the CAS number of 2-Ethoxy-6-methyl-3,1-benzoxazin-4-one?
The CAS number of 2-Ethoxy-6-methyl-3,1-benzoxazin-4-one is 135498-43-0.
What is the molecular formula of 2-Ethoxy-6-methyl-3,1-benzoxazin-4-one?
The molecular formula of 2-Ethoxy-6-methyl-3,1-benzoxazin-4-one is C11H11NO3.
What is the molecular weight of 2-Ethoxy-6-methyl-3,1-benzoxazin-4-one?
The molecular weight of 2-Ethoxy-6-methyl-3,1-benzoxazin-4-one is 205.0739 g/mol.
Where can I buy 2-Ethoxy-6-methyl-3,1-benzoxazin-4-one?
You can request a quote for 2-Ethoxy-6-methyl-3,1-benzoxazin-4-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Ethoxy-6-methyl-3,1-benzoxazin-4-one?
Yes, CoreyChem provides custom synthesis services for 2-Ethoxy-6-methyl-3,1-benzoxazin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.