Robustone methyl ether
TL;DR: Robustone methyl ether (CAS 22044-57-1) is a chemical compound with molecular formula C22H18O6 and molecular weight 378.11 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-methoxy-2,2-dimethylpyrano[3,2-g]chromen-6-one
Also Known As: METHYL ROBUSTONE, Robustone methyl ether, Spectrum2_000826, Spectrum3_001775, Spectrum4_001835
| Molecular Formula | C22H18O6 |
|---|---|
| Molecular Weight | 378.11 g/mol |
| LogP | 4.3815 |
| Topological Polar Surface Area | 67.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 378.11035 |
| Heavy Atoms | 28 |
| Complexity | 1201.853 |
Chemical Identifiers
| CAS Number | 22044-57-1 |
|---|---|
| SMILES | CC1(C=CC2=C(O1)C=C3C(=C2OC)C(=O)C(=CO3)C4=CC5=C(C=C4)OCO5)C |
Product Overview
Robustone methyl ether (CAS 22044-57-1), with molecular formula C22H18O6 and molecular weight 378.11 g/mol. IUPAC: 7-(1,3-benzodioxol-5-yl)-5-methoxy-2,2-dimethylpyrano[3,2-g]chromen-6-one.
Chemical Property Profile of Robustone methyl ether
Property Insights of Robustone methyl ether
The XLogP value of 4.3815 indicates that Robustone methyl ether is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.13 Ų falls within the moderate polarity range, balancing permeability and solubility for Robustone methyl ether. Following Lipinski's Rule of Five, Robustone methyl ether has 0 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 methyl ether?
The CAS number of Robustone methyl ether is 22044-57-1.
What is the molecular formula of Robustone methyl ether?
The molecular formula of Robustone methyl ether is C22H18O6.
What is the molecular weight of Robustone methyl ether?
The molecular weight of Robustone methyl ether is 378.11 g/mol.
Where can I buy Robustone methyl ether?
You can request a quote for Robustone methyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Robustone methyl ether?
Yes, KEHONG BIO provides custom synthesis services for Robustone methyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.