![5-(4-chlorophenoxy)-6H-anthra[1,9-cd]isoxazol-6-one structure](/static/products/884/88422-67-7.png)
5-(4-chlorophenoxy)-6H-anthra[1,9-cd]isoxazol-6-one
TL;DR: 5-(4-chlorophenoxy)-6H-anthra[1,9-cd]isoxazol-6-one (CAS 88422-67-7) is a chemical compound with molecular formula C20H10ClNO3 and molecular weight 347.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-(4-chlorophenoxy)-15-oxa-14-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1(16),2,4,6,9,11,13-heptaen-8-one
Also Known As: ChemDiv1_019009, BIM-0020884.P001, 5-(4-chlorophenoxy)-6H-anthra[1,9-cd]isoxazol-6-one, 5-(4-chlorophenoxy)-6H-anthra[1,9-cd][1,2]oxazol-6-one
| Molecular Formula | C20H10ClNO3 |
|---|---|
| Molecular Weight | 347.03 g/mol |
| LogP | 5.4849 |
| Topological Polar Surface Area | 52.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 347.0349 |
| Heavy Atoms | 25 |
| Complexity | 1145.54 |
Chemical Identifiers
| CAS Number | 88422-67-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=C4C(=NO3)C=CC(=C4C2=O)OC5=CC=C(C=C5)Cl |
Product Overview
5-(4-chlorophenoxy)-6H-anthra[1,9-cd]isoxazol-6-one (CAS 88422-67-7), with molecular formula C20H10ClNO3 and molecular weight 347.03 g/mol. IUPAC: 10-(4-chlorophenoxy)-15-oxa-14-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1(16),2,4,6,9,11,13-heptaen-8-one.
Chemical Property Profile of 5-(4-chlorophenoxy)-6H-anthra[1,9-cd]isoxazol-6-one
Property Insights of 5-(4-chlorophenoxy)-6H-anthra[1,9-cd]isoxazol-6-one
The XLogP value of 5.4849 indicates that 5-(4-chlorophenoxy)-6H-anthra[1,9-cd]isoxazol-6-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.33 Ų, 5-(4-chlorophenoxy)-6H-anthra[1,9-cd]isoxazol-6-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(4-chlorophenoxy)-6H-anthra[1,9-cd]isoxazol-6-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-(4-chlorophenoxy)-6H-anthra[1,9-cd]isoxazol-6-one?
The CAS number of 5-(4-chlorophenoxy)-6H-anthra[1,9-cd]isoxazol-6-one is 88422-67-7.
What is the molecular formula of 5-(4-chlorophenoxy)-6H-anthra[1,9-cd]isoxazol-6-one?
The molecular formula of 5-(4-chlorophenoxy)-6H-anthra[1,9-cd]isoxazol-6-one is C20H10ClNO3.
What is the molecular weight of 5-(4-chlorophenoxy)-6H-anthra[1,9-cd]isoxazol-6-one?
The molecular weight of 5-(4-chlorophenoxy)-6H-anthra[1,9-cd]isoxazol-6-one is 347.03 g/mol.
Where can I buy 5-(4-chlorophenoxy)-6H-anthra[1,9-cd]isoxazol-6-one?
You can request a quote for 5-(4-chlorophenoxy)-6H-anthra[1,9-cd]isoxazol-6-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(4-chlorophenoxy)-6H-anthra[1,9-cd]isoxazol-6-one?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-chlorophenoxy)-6H-anthra[1,9-cd]isoxazol-6-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.