5-Chlorobenzo(d)isoxazol-3-ol
TL;DR: 5-Chlorobenzo(d)isoxazol-3-ol (CAS 24603-63-2) is a chemical compound with molecular formula C7H4ClNO2 and molecular weight 168.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-1,2-benzoxazol-3-one
Also Known As: 5-chlorobenzo[d]isoxazol-3-ol, CBIO compound, 5-Chloro-3-hydroxybenzisoxazole, 5-chloro-1,2-benzoxazol-3-one, 5-chloro-1,2-benzoxazol-3-ol
| Molecular Formula | C7H4ClNO2 |
|---|---|
| Molecular Weight | 168.99 g/mol |
| LogP | 1.7745 |
| Topological Polar Surface Area | 46.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 168.99306 |
| Heavy Atoms | 11 |
| Complexity | 442.88245 |
Chemical Identifiers
| CAS Number | 24603-63-2 |
|---|---|
| SMILES | C1=CC2=C(C=C1Cl)C(=O)NO2 |
Product Overview
5-Chlorobenzo(d)isoxazol-3-ol (CAS 24603-63-2), with molecular formula C7H4ClNO2 and molecular weight 168.99 g/mol. IUPAC: 5-chloro-1,2-benzoxazol-3-one.
Chemical Property Profile of 5-Chlorobenzo(d)isoxazol-3-ol
Property Insights of 5-Chlorobenzo(d)isoxazol-3-ol
The XLogP value of 1.7745 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Chlorobenzo(d)isoxazol-3-ol. With a topological polar surface area (TPSA) of 46.0 Ų, 5-Chlorobenzo(d)isoxazol-3-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chlorobenzo(d)isoxazol-3-ol has 1 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-Chlorobenzo(d)isoxazol-3-ol?
The CAS number of 5-Chlorobenzo(d)isoxazol-3-ol is 24603-63-2.
What is the molecular formula of 5-Chlorobenzo(d)isoxazol-3-ol?
The molecular formula of 5-Chlorobenzo(d)isoxazol-3-ol is C7H4ClNO2.
What is the molecular weight of 5-Chlorobenzo(d)isoxazol-3-ol?
The molecular weight of 5-Chlorobenzo(d)isoxazol-3-ol is 168.99 g/mol.
Where can I buy 5-Chlorobenzo(d)isoxazol-3-ol?
You can request a quote for 5-Chlorobenzo(d)isoxazol-3-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chlorobenzo(d)isoxazol-3-ol?
Yes, KEHONG BIO provides custom synthesis services for 5-Chlorobenzo(d)isoxazol-3-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.