6-Chlorobenzoxazole
TL;DR: 6-Chlorobenzoxazole (CAS 227197-72-0) is a chemical compound with molecular formula C7H4ClNO and molecular weight 153.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-1,3-benzoxazole
Also Known As: 6-Chlorobenzo[d]oxazole, 6-CHLOROBENZOXAZOLE, 6-CHLORO-1,3-BENZOXAZOLE, 6-CHLORO-BENZOXAZOLE, 6-chloro-benzooxazole
| Molecular Formula | C7H4ClNO |
|---|---|
| Molecular Weight | 153.00 g/mol |
| LogP | 2.4812 |
| Topological Polar Surface Area | 26.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 152.99814 |
| Heavy Atoms | 10 |
| Complexity | 355.1336 |
Chemical Identifiers
| CAS Number | 227197-72-0 |
|---|---|
| SMILES | C1=CC2=C(C=C1Cl)OC=N2 |
Product Overview
6-Chlorobenzoxazole (CAS 227197-72-0), with molecular formula C7H4ClNO and molecular weight 153.00 g/mol. IUPAC: 6-chloro-1,3-benzoxazole.
Chemical Property Profile of 6-Chlorobenzoxazole
Property Insights of 6-Chlorobenzoxazole
The XLogP value of 2.4812 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Chlorobenzoxazole. With a topological polar surface area (TPSA) of 26.03 Ų, 6-Chlorobenzoxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Chlorobenzoxazole 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 6-Chlorobenzoxazole?
The CAS number of 6-Chlorobenzoxazole is 227197-72-0.
What is the molecular formula of 6-Chlorobenzoxazole?
The molecular formula of 6-Chlorobenzoxazole is C7H4ClNO.
What is the molecular weight of 6-Chlorobenzoxazole?
The molecular weight of 6-Chlorobenzoxazole is 153.00 g/mol.
Where can I buy 6-Chlorobenzoxazole?
You can request a quote for 6-Chlorobenzoxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Chlorobenzoxazole?
Yes, KEHONG BIO provides custom synthesis services for 6-Chlorobenzoxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.