![[2-Hydroxy-3-(5-oxofuran-2-ylidene)propyl] benzoate structure](/static/products/1356/135626-19-6.webp)
[2-Hydroxy-3-(5-oxofuran-2-ylidene)propyl] benzoate
TL;DR: [2-Hydroxy-3-(5-oxofuran-2-ylidene)propyl] benzoate (CAS 135626-19-6) is a chemical compound with molecular formula C14H12O5 and molecular weight 260.06848 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-hydroxy-3-(5-oxofuran-2-ylidene)propyl] benzoate
Also Known As: Melodorinol, [2-hydroxy-3-(5-oxofuran-2-ylidene)propyl] benzoate, 2-hydroxy-3-(5-oxofuran-2(5H)-ylidene)propyl benzoate, [(2S,3Z)-2-hydroxy-3-(5-oxofuran-2-ylidene)propyl] benzoate
Technical Specifications
| Molecular Formula | C14H12O5 |
| Molecular Weight | 260.06848 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 72.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 260.06848 Da |
| Heavy Atoms | 19 |
| Complexity | 404.0 |
| SMILES | C1=CC=C(C=C1)C(=O)OCC(C=C2C=CC(=O)O2)O |
| InChIKey | WQHRXHYOKDRIRR-UHFFFAOYSA-N |
Chemical Property Profile of [2-Hydroxy-3-(5-oxofuran-2-ylidene)propyl] benzoate
Property Insights of [2-Hydroxy-3-(5-oxofuran-2-ylidene)propyl] benzoate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-Hydroxy-3-(5-oxofuran-2-ylidene)propyl] benzoate. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-Hydroxy-3-(5-oxofuran-2-ylidene)propyl] benzoate. Following Lipinski's Rule of Five, [2-Hydroxy-3-(5-oxofuran-2-ylidene)propyl] benzoate has 1 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-Hydroxy-3-(5-oxofuran-2-ylidene)propyl] benzoate?
The CAS number of [2-Hydroxy-3-(5-oxofuran-2-ylidene)propyl] benzoate is 135626-19-6.
What is the molecular formula of [2-Hydroxy-3-(5-oxofuran-2-ylidene)propyl] benzoate?
The molecular formula of [2-Hydroxy-3-(5-oxofuran-2-ylidene)propyl] benzoate is C14H12O5.
What is the molecular weight of [2-Hydroxy-3-(5-oxofuran-2-ylidene)propyl] benzoate?
The molecular weight of [2-Hydroxy-3-(5-oxofuran-2-ylidene)propyl] benzoate is 260.06848 g/mol.
Where can I buy [2-Hydroxy-3-(5-oxofuran-2-ylidene)propyl] benzoate?
You can request a quote for [2-Hydroxy-3-(5-oxofuran-2-ylidene)propyl] benzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for [2-Hydroxy-3-(5-oxofuran-2-ylidene)propyl] benzoate?
Yes, CoreyChem provides custom synthesis services for [2-Hydroxy-3-(5-oxofuran-2-ylidene)propyl] benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.