2-(3,4-Dihydroxybenzylidene)-6-hydroxybenzofuran-3(2H)-one
TL;DR: 2-(3,4-Dihydroxybenzylidene)-6-hydroxybenzofuran-3(2H)-one (CAS 100433-06-5) is a chemical compound with molecular formula C15H10O5 and molecular weight 270.05283 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2E)-2-[(3,4-dihydroxyphenyl)methylidene]-6-hydroxy-1-benzofuran-3-one
Also Known As: Sulfuretin, 3',4',6-Trihydroxyaurone, 2-(3,4-Dihydroxybenzylidene)-6-hydroxybenzofuran-3(2H)-one, 2-[(3,4-dihydroxyphenyl)methylidene]-6-hydroxy-1-benzofuran-3-one, 2-[(3,4-dihydroxyphenyl)methylene]-6-hydroxybenzo[b]furan-3-one
Technical Specifications
| Molecular Formula | C15H10O5 |
| Molecular Weight | 270.05283 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 87.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 270.05283 Da |
| Heavy Atoms | 20 |
| Complexity | 418.0 |
| SMILES | C1=CC(=C(C=C1/C=C/2\C(=O)C3=C(O2)C=C(C=C3)O)O)O |
| InChIKey | RGNXWPVNPFAADO-MKMNVTDBSA-N |
Chemical Property Profile of 2-(3,4-Dihydroxybenzylidene)-6-hydroxybenzofuran-3(2H)-one
Property Insights of 2-(3,4-Dihydroxybenzylidene)-6-hydroxybenzofuran-3(2H)-one
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3,4-Dihydroxybenzylidene)-6-hydroxybenzofuran-3(2H)-one. The TPSA of 87.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3,4-Dihydroxybenzylidene)-6-hydroxybenzofuran-3(2H)-one. Following Lipinski's Rule of Five, 2-(3,4-Dihydroxybenzylidene)-6-hydroxybenzofuran-3(2H)-one has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(3,4-Dihydroxybenzylidene)-6-hydroxybenzofuran-3(2H)-one?
The CAS number of 2-(3,4-Dihydroxybenzylidene)-6-hydroxybenzofuran-3(2H)-one is 100433-06-5.
What is the molecular formula of 2-(3,4-Dihydroxybenzylidene)-6-hydroxybenzofuran-3(2H)-one?
The molecular formula of 2-(3,4-Dihydroxybenzylidene)-6-hydroxybenzofuran-3(2H)-one is C15H10O5.
What is the molecular weight of 2-(3,4-Dihydroxybenzylidene)-6-hydroxybenzofuran-3(2H)-one?
The molecular weight of 2-(3,4-Dihydroxybenzylidene)-6-hydroxybenzofuran-3(2H)-one is 270.05283 g/mol.
Where can I buy 2-(3,4-Dihydroxybenzylidene)-6-hydroxybenzofuran-3(2H)-one?
You can request a quote for 2-(3,4-Dihydroxybenzylidene)-6-hydroxybenzofuran-3(2H)-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(3,4-Dihydroxybenzylidene)-6-hydroxybenzofuran-3(2H)-one?
Yes, CoreyChem provides custom synthesis services for 2-(3,4-Dihydroxybenzylidene)-6-hydroxybenzofuran-3(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.