3-(1,3-Oxazol-5-yl)aniline
TL;DR: 3-(1,3-Oxazol-5-yl)aniline (CAS 157837-31-5) is a chemical compound with molecular formula C9H8N2O and molecular weight 160.06366 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(1,3-oxazol-5-yl)aniline
Also Known As: 3-(1,3-oxazol-5-yl)aniline, 3-(5-oxazolyl)aniline, 5-(3-Aminophenyl)oxazole, 3-(Oxazol-5-yl)aniline, Benzenamine, 3-(5-oxazolyl)-
Technical Specifications
| Molecular Formula | C9H8N2O |
| Molecular Weight | 160.06366 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 52.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 160.06366 Da |
| Heavy Atoms | 12 |
| Complexity | 151.0 |
| SMILES | C1=CC(=CC(=C1)N)C2=CN=CO2 |
| InChIKey | AIELNJDAOGTASK-UHFFFAOYSA-N |
Chemical Property Profile of 3-(1,3-Oxazol-5-yl)aniline
Property Insights of 3-(1,3-Oxazol-5-yl)aniline
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1,3-Oxazol-5-yl)aniline. With a topological polar surface area (TPSA) of 52.1 Ų, 3-(1,3-Oxazol-5-yl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1,3-Oxazol-5-yl)aniline 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 3-(1,3-Oxazol-5-yl)aniline?
The CAS number of 3-(1,3-Oxazol-5-yl)aniline is 157837-31-5.
What is the molecular formula of 3-(1,3-Oxazol-5-yl)aniline?
The molecular formula of 3-(1,3-Oxazol-5-yl)aniline is C9H8N2O.
What is the molecular weight of 3-(1,3-Oxazol-5-yl)aniline?
The molecular weight of 3-(1,3-Oxazol-5-yl)aniline is 160.06366 g/mol.
Where can I buy 3-(1,3-Oxazol-5-yl)aniline?
You can request a quote for 3-(1,3-Oxazol-5-yl)aniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(1,3-Oxazol-5-yl)aniline?
Yes, CoreyChem provides custom synthesis services for 3-(1,3-Oxazol-5-yl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.