3-(2-Fluorophenyl)-5-isoxazolamine
TL;DR: 3-(2-Fluorophenyl)-5-isoxazolamine (CAS 119162-49-1) is a chemical compound with molecular formula C9H7FN2O and molecular weight 178.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-fluorophenyl)-1,2-oxazol-5-amine
Also Known As: 3-(2-fluorophenyl)-1,2-oxazol-5-amine, 3-(2-Fluorophenyl)isoxazol-5-amine, 5-Isoxazolamine, 3-(2-fluorophenyl)-, 3-(2-FLUORO-PHENYL)-ISOXAZOL-5-YLAMINE, SALOR-INT L482951-1EA
| Molecular Formula | C9H7FN2O |
|---|---|
| Molecular Weight | 178.05 g/mol |
| LogP | 2.0629 |
| Topological Polar Surface Area | 52.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 178.05424 |
| Heavy Atoms | 13 |
| Complexity | 425.05798 |
Chemical Identifiers
| CAS Number | 119162-49-1 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C2=NOC(=C2)N)F |
Product Overview
3-(2-Fluorophenyl)-5-isoxazolamine (CAS 119162-49-1), with molecular formula C9H7FN2O and molecular weight 178.05 g/mol. IUPAC: 3-(2-fluorophenyl)-1,2-oxazol-5-amine.
Chemical Property Profile of 3-(2-Fluorophenyl)-5-isoxazolamine
Property Insights of 3-(2-Fluorophenyl)-5-isoxazolamine
The XLogP value of 2.0629 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-Fluorophenyl)-5-isoxazolamine. With a topological polar surface area (TPSA) of 52.05 Ų, 3-(2-Fluorophenyl)-5-isoxazolamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-Fluorophenyl)-5-isoxazolamine 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
Frequently Asked Questions
What is the CAS number of 3-(2-Fluorophenyl)-5-isoxazolamine?
The CAS number of 3-(2-Fluorophenyl)-5-isoxazolamine is 119162-49-1.
What is the molecular formula of 3-(2-Fluorophenyl)-5-isoxazolamine?
The molecular formula of 3-(2-Fluorophenyl)-5-isoxazolamine is C9H7FN2O.
What is the molecular weight of 3-(2-Fluorophenyl)-5-isoxazolamine?
The molecular weight of 3-(2-Fluorophenyl)-5-isoxazolamine is 178.05 g/mol.
Where can I buy 3-(2-Fluorophenyl)-5-isoxazolamine?
You can request a quote for 3-(2-Fluorophenyl)-5-isoxazolamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Fluorophenyl)-5-isoxazolamine?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Fluorophenyl)-5-isoxazolamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.