3-(3-Chlorophenyl)-1,2-oxazol-5-amine
TL;DR: 3-(3-Chlorophenyl)-1,2-oxazol-5-amine (CAS 86685-95-2) is a chemical compound with molecular formula C9H7ClN2O and molecular weight 194.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-chlorophenyl)-1,2-oxazol-5-amine
Also Known As: 3-(3-Chlorophenyl)isoxazol-5-amine, 3-(3-Chlorophenyl)-5-isoxazolamine, 2-Hexyl-1-octene, 3-(3-chlorophenyl)-1,2-oxazol-5-amine, 5-Amino-3-(3-chlorophenyl)isoxazole
| Molecular Formula | C9H7ClN2O |
|---|---|
| Molecular Weight | 194.02 g/mol |
| LogP | 2.5772 |
| Topological Polar Surface Area | 52.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 194.02469 |
| Heavy Atoms | 13 |
| Complexity | 425.05798 |
Chemical Identifiers
| CAS Number | 86685-95-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)C2=NOC(=C2)N |
Product Overview
3-(3-Chlorophenyl)-1,2-oxazol-5-amine (CAS 86685-95-2), with molecular formula C9H7ClN2O and molecular weight 194.02 g/mol. IUPAC: 3-(3-chlorophenyl)-1,2-oxazol-5-amine.
Chemical Property Profile of 3-(3-Chlorophenyl)-1,2-oxazol-5-amine
Property Insights of 3-(3-Chlorophenyl)-1,2-oxazol-5-amine
The XLogP value of 2.5772 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3-Chlorophenyl)-1,2-oxazol-5-amine. With a topological polar surface area (TPSA) of 52.05 Ų, 3-(3-Chlorophenyl)-1,2-oxazol-5-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3-Chlorophenyl)-1,2-oxazol-5-amine 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-(3-Chlorophenyl)-1,2-oxazol-5-amine?
The CAS number of 3-(3-Chlorophenyl)-1,2-oxazol-5-amine is 86685-95-2.
What is the molecular formula of 3-(3-Chlorophenyl)-1,2-oxazol-5-amine?
The molecular formula of 3-(3-Chlorophenyl)-1,2-oxazol-5-amine is C9H7ClN2O.
What is the molecular weight of 3-(3-Chlorophenyl)-1,2-oxazol-5-amine?
The molecular weight of 3-(3-Chlorophenyl)-1,2-oxazol-5-amine is 194.02 g/mol.
Where can I buy 3-(3-Chlorophenyl)-1,2-oxazol-5-amine?
You can request a quote for 3-(3-Chlorophenyl)-1,2-oxazol-5-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-Chlorophenyl)-1,2-oxazol-5-amine?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-Chlorophenyl)-1,2-oxazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.