Robustone
TL;DR: Robustone (CAS 22044-56-0) is a chemical compound with molecular formula C21H16O6 and molecular weight 364.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(1,3-benzodioxol-5-yl)-5-hydroxy-2,2-dimethylpyrano[3,2-g]chromen-6-one
Also Known As: robustone, Spectrum3_001734, Spectrum4_001545, Spectrum5_000110, SPECTRUM210454
| Molecular Formula | C21H16O6 |
|---|---|
| Molecular Weight | 364.09 g/mol |
| LogP | 4.0785 |
| Topological Polar Surface Area | 78.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 364.0947 |
| Heavy Atoms | 27 |
| Complexity | 1185.4766 |
Chemical Identifiers
| CAS Number | 22044-56-0 |
|---|---|
| SMILES | CC1(C=CC2=C(O1)C=C3C(=C2O)C(=O)C(=CO3)C4=CC5=C(C=C4)OCO5)C |
Product Overview
Robustone (CAS 22044-56-0), with molecular formula C21H16O6 and molecular weight 364.09 g/mol. IUPAC: 7-(1,3-benzodioxol-5-yl)-5-hydroxy-2,2-dimethylpyrano[3,2-g]chromen-6-one.
Chemical Property Profile of Robustone
Property Insights of Robustone
The XLogP value of 4.0785 indicates that Robustone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.13 Ų falls within the moderate polarity range, balancing permeability and solubility for Robustone. Following Lipinski's Rule of Five, Robustone 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 Robustone?
The CAS number of Robustone is 22044-56-0.
What is the molecular formula of Robustone?
The molecular formula of Robustone is C21H16O6.
What is the molecular weight of Robustone?
The molecular weight of Robustone is 364.09 g/mol.
Where can I buy Robustone?
You can request a quote for Robustone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Robustone?
Yes, KEHONG BIO provides custom synthesis services for Robustone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.