5-Bromo-4-phenyloxazole
TL;DR: 5-Bromo-4-phenyloxazole (CAS 20756-97-2) is a chemical compound with molecular formula C9H6BrNO and molecular weight 222.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-4-phenyl-1,3-oxazole
Also Known As: Oxazole, 5-bromo-4-phenyl-, 5-Bromo-4-phenyl-1,3-oxazole, 5-Bromo-4-phenyloxazole, 5-Bromo-4-phenyl-1,3-oxazole #, 870-312-7
| Molecular Formula | C9H6BrNO |
|---|---|
| Molecular Weight | 222.96 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 222.96329 |
| Heavy Atoms | 12 |
| Complexity | 147.0 |
Chemical Identifiers
| CAS Number | 20756-97-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=C(OC=N2)Br |
| InChIKey | AJSYUPQDOBPXGA-UHFFFAOYSA-N |
Product Overview
5-Bromo-4-phenyloxazole (CAS 20756-97-2), with molecular formula C9H6BrNO and molecular weight 222.96 g/mol. IUPAC: 5-bromo-4-phenyl-1,3-oxazole.
Chemical Property Profile of 5-Bromo-4-phenyloxazole
Property Insights of 5-Bromo-4-phenyloxazole
The XLogP value of 3.0 indicates that 5-Bromo-4-phenyloxazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.0 Ų, 5-Bromo-4-phenyloxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Bromo-4-phenyloxazole has 0 hydrogen bond donor(s) and 2 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 5-Bromo-4-phenyloxazole?
The CAS number of 5-Bromo-4-phenyloxazole is 20756-97-2.
What is the molecular formula of 5-Bromo-4-phenyloxazole?
The molecular formula of 5-Bromo-4-phenyloxazole is C9H6BrNO.
What is the molecular weight of 5-Bromo-4-phenyloxazole?
The molecular weight of 5-Bromo-4-phenyloxazole is 222.96 g/mol.
Where can I buy 5-Bromo-4-phenyloxazole?
You can request a quote for 5-Bromo-4-phenyloxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Bromo-4-phenyloxazole?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromo-4-phenyloxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.