Cassigarol E
TL;DR: Cassigarol E (CAS 158732-56-0) is a chemical compound with molecular formula C28H22O8 and molecular weight 486.13147 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(2R,3R)-2-(3,5-dihydroxyphenyl)-6-[(E)-2-(3,5-dihydroxyphenyl)ethenyl]-2,3-dihydro-1,4-benzodioxin-3-yl]benzene-1,2-diol
Also Known As: cassigarol E, Cassigerol G, 4-[(2R,3R)-2-(3,5-dihydroxyphenyl)-6-[(E)-2-(3,5-dihydroxyphenyl)ethenyl]-2,3-dihydro-1,4-benzodioxin-3-yl]benzene-1,2-diol, 2,3-Dihydro-2alpha-(3,5-dihydroxyphenyl)-3beta-(3,4-dihydroxyphenyl)-6-[(E)-2-(3,5-dihydroxyphenyl)ethenyl]-1,4-benzodioxin, 4-((2R,3R)-2-(3,5-dihydroxyphenyl)-6-((E)-2-(3,5-dihydroxyphenyl)ethenyl)-2,3-dihydro-1,4-benzodioxin-3-yl)benzene-1,2-diol
Technical Specifications
| Molecular Formula | C28H22O8 |
| Molecular Weight | 486.13147 g/mol |
| XLogP | 4.8 |
| Topological Polar Surface Area (TPSA) | 140.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 486.13147 Da |
| Heavy Atoms | 36 |
| Complexity | 727.0 |
| SMILES | C1=CC2=C(C=C1/C=C/C3=CC(=CC(=C3)O)O)O[C@@H]([C@H](O2)C4=CC(=CC(=C4)O)O)C5=CC(=C(C=C5)O)O |
| InChIKey | PKWWKWRCCYGTHQ-DPBCGFEQSA-N |
Chemical Property Profile of Cassigarol E
Property Insights of Cassigarol E
The XLogP value of 4.8 indicates that Cassigarol E is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 140.0 Ų indicates high polarity, suggesting Cassigarol E may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cassigarol E has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Cassigarol E?
The CAS number of Cassigarol E is 158732-56-0.
What is the molecular formula of Cassigarol E?
The molecular formula of Cassigarol E is C28H22O8.
What is the molecular weight of Cassigarol E?
The molecular weight of Cassigarol E is 486.13147 g/mol.
Where can I buy Cassigarol E?
You can request a quote for Cassigarol E directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Cassigarol E?
Yes, CoreyChem provides custom synthesis services for Cassigarol E and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.