Irisone A
TL;DR: Irisone A (CAS 2652-16-6) is a chemical compound with molecular formula C17H12O6 and molecular weight 312.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-hydroxy-7-(2-methoxyphenyl)-[1,3]dioxolo[4,5-g]chromen-8-one
Also Known As: Irisone A, 5-Hydroxy-2'-methoxy-6,7-methylenedioxyisoflavone, 5-hydroxy-2'-methoxy-6,7-methylenedioxy-isoflavone, 9-hydroxy-7-(2-methoxyphenyl)-[1,3]dioxolo[4,5-g]chromen-8-one, 8H-1,3-Dioxolo(4,5-g)(1)benzopyran-8-one, 9-hydroxy-7-(2-methoxyphenyl)-
| Molecular Formula | C17H12O6 |
|---|---|
| Molecular Weight | 312.06 g/mol |
| LogP | 2.9029 |
| Topological Polar Surface Area | 78.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 312.0634 |
| Heavy Atoms | 23 |
| Complexity | 972.7149 |
Chemical Identifiers
| CAS Number | 2652-16-6 |
|---|---|
| SMILES | COC1=CC=CC=C1C2=COC3=CC4=C(C(=C3C2=O)O)OCO4 |
Product Overview
Irisone A (CAS 2652-16-6), with molecular formula C17H12O6 and molecular weight 312.06 g/mol. IUPAC: 9-hydroxy-7-(2-methoxyphenyl)-[1,3]dioxolo[4,5-g]chromen-8-one.
Chemical Property Profile of Irisone A
Property Insights of Irisone A
The XLogP value of 2.9029 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Irisone A. The TPSA of 78.13 Ų falls within the moderate polarity range, balancing permeability and solubility for Irisone A. Following Lipinski's Rule of Five, Irisone A has 1 hydrogen bond donor(s) and 6 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 Irisone A?
The CAS number of Irisone A is 2652-16-6.
What is the molecular formula of Irisone A?
The molecular formula of Irisone A is C17H12O6.
What is the molecular weight of Irisone A?
The molecular weight of Irisone A is 312.06 g/mol.
Where can I buy Irisone A?
You can request a quote for Irisone A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Irisone A?
Yes, KEHONG BIO provides custom synthesis services for Irisone A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.