Isoxazole, 5-(methoxymethyl)-3-methyl-
TL;DR: Isoxazole, 5-(methoxymethyl)-3-methyl- (CAS 13999-31-0) is a chemical compound with molecular formula C6H9NO2 and molecular weight 127.06333 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(methoxymethyl)-3-methyl-1,2-oxazole
Also Known As: 5-(Methoxymethyl)-3-methylisoxazole, 3-methyl-5-methoxymethylisoxazole, 5-methoxymethyl-3-methylisoxazole, Isoxazole, 5-(methoxymethyl)-3-methyl-, 5-(methoxymethyl)-3-methyl-1,2-oxazole
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H9NO2 |
| Molecular Weight | 127.06333 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 35.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 127.06333 Da |
| Heavy Atoms | 9 |
| Complexity | 87.0 |
| SMILES | CC1=NOC(=C1)COC |
| InChIKey | BIHKMPQQASOGPQ-UHFFFAOYSA-N |
Chemical Property Profile of Isoxazole, 5-(methoxymethyl)-3-methyl-
Property Insights of Isoxazole, 5-(methoxymethyl)-3-methyl-
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isoxazole, 5-(methoxymethyl)-3-methyl-. With a topological polar surface area (TPSA) of 35.3 Ų, Isoxazole, 5-(methoxymethyl)-3-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoxazole, 5-(methoxymethyl)-3-methyl- has 0 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 Isoxazole, 5-(methoxymethyl)-3-methyl-?
The CAS number of Isoxazole, 5-(methoxymethyl)-3-methyl- is 13999-31-0.
What is the molecular formula of Isoxazole, 5-(methoxymethyl)-3-methyl-?
The molecular formula of Isoxazole, 5-(methoxymethyl)-3-methyl- is C6H9NO2.
What is the molecular weight of Isoxazole, 5-(methoxymethyl)-3-methyl-?
The molecular weight of Isoxazole, 5-(methoxymethyl)-3-methyl- is 127.06333 g/mol.
Where can I buy Isoxazole, 5-(methoxymethyl)-3-methyl-?
You can request a quote for Isoxazole, 5-(methoxymethyl)-3-methyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Isoxazole, 5-(methoxymethyl)-3-methyl-?
Yes, CoreyChem provides custom synthesis services for Isoxazole, 5-(methoxymethyl)-3-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.