5-Aminoisoxazole
TL;DR: 5-Aminoisoxazole (CAS 14678-05-8) is a chemical compound with molecular formula C3H4N2O and molecular weight 84.032364 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2-oxazol-5-amine
Also Known As: Isoxazol-5-amine, 5-Aminoisoxazole, 5-Isoxazolamine, 1,2-oxazol-5-amine, ISOXAZOL-5-YLAMINE
Application Areas
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C3H4N2O |
| Molecular Weight | 84.032364 g/mol |
| XLogP | 0.0 |
| Topological Polar Surface Area (TPSA) | 52.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 84.032364 Da |
| Heavy Atoms | 6 |
| Complexity | 48.0 |
| SMILES | C1=C(ON=C1)N |
| InChIKey | IAXWZYXUKABJAN-UHFFFAOYSA-N |
Chemical Property Profile of 5-Aminoisoxazole
Property Insights of 5-Aminoisoxazole
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Aminoisoxazole. With a topological polar surface area (TPSA) of 52.1 Ų, 5-Aminoisoxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Aminoisoxazole 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-Aminoisoxazole?
The CAS number of 5-Aminoisoxazole is 14678-05-8.
What is the molecular formula of 5-Aminoisoxazole?
The molecular formula of 5-Aminoisoxazole is C3H4N2O.
What is the molecular weight of 5-Aminoisoxazole?
The molecular weight of 5-Aminoisoxazole is 84.032364 g/mol.
Where can I buy 5-Aminoisoxazole?
You can request a quote for 5-Aminoisoxazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Aminoisoxazole?
Yes, CoreyChem provides custom synthesis services for 5-Aminoisoxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.