5-Amino-3-methylisoxazole
TL;DR: 5-Amino-3-methylisoxazole (CAS 14678-02-5) is a chemical compound with molecular formula C4H6N2O and molecular weight 98.04801 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-methyl-1,2-oxazol-5-amine
Also Known As: 5-Amino-3-methylisoxazole, 3-Methylisoxazol-5-amine, 5-Isoxazolamine, 3-methyl-, 3-methyl-1,2-oxazol-5-amine, 3-Methyl-5-aminoisoxazole
Application Areas
Top 5 of 10 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C4H6N2O |
| Molecular Weight | 98.04801 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 52.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 98.04801 Da |
| Heavy Atoms | 7 |
| Complexity | 66.0 |
| SMILES | CC1=NOC(=C1)N |
| InChIKey | FNXYWHTZDAVRTB-UHFFFAOYSA-N |
Chemical Property Profile of 5-Amino-3-methylisoxazole
Property Insights of 5-Amino-3-methylisoxazole
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Amino-3-methylisoxazole. With a topological polar surface area (TPSA) of 52.1 Ų, 5-Amino-3-methylisoxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Amino-3-methylisoxazole 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
What is the CAS number of 5-Amino-3-methylisoxazole?
The CAS number of 5-Amino-3-methylisoxazole is 14678-02-5.
What is the molecular formula of 5-Amino-3-methylisoxazole?
The molecular formula of 5-Amino-3-methylisoxazole is C4H6N2O.
What is the molecular weight of 5-Amino-3-methylisoxazole?
The molecular weight of 5-Amino-3-methylisoxazole is 98.04801 g/mol.
Where can I buy 5-Amino-3-methylisoxazole?
You can request a quote for 5-Amino-3-methylisoxazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Amino-3-methylisoxazole?
Yes, CoreyChem provides custom synthesis services for 5-Amino-3-methylisoxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.