Acetylmelodorinol
TL;DR: Acetylmelodorinol (CAS 130518-22-8) is a chemical compound with molecular formula C16H14O6 and molecular weight 302.07904 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(3Z)-2-acetyloxy-3-(5-oxofuran-2-ylidene)propyl] benzoate
Also Known As: acetylmelodorinol, [(3Z)-2-acetyloxy-3-(5-oxofuran-2-ylidene)propyl] benzoate, ((3Z)-2-acetyloxy-3-(5-oxofuran-2-ylidene)propyl) benzoate, 2-(acetyloxy)-3-(5-oxofuran-2(5H)-ylidene)propyl benzoate
Technical Specifications
| Molecular Formula | C16H14O6 |
| Molecular Weight | 302.07904 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 302.07904 Da |
| Heavy Atoms | 22 |
| Complexity | 499.0 |
| SMILES | CC(=O)OC(COC(=O)C1=CC=CC=C1)/C=C\2/C=CC(=O)O2 |
| InChIKey | GRILELGQNUBIAJ-LCYFTJDESA-N |
Chemical Property Profile of Acetylmelodorinol
Property Insights of Acetylmelodorinol
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetylmelodorinol. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetylmelodorinol. Following Lipinski's Rule of Five, Acetylmelodorinol 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
What is the CAS number of Acetylmelodorinol?
The CAS number of Acetylmelodorinol is 130518-22-8.
What is the molecular formula of Acetylmelodorinol?
The molecular formula of Acetylmelodorinol is C16H14O6.
What is the molecular weight of Acetylmelodorinol?
The molecular weight of Acetylmelodorinol is 302.07904 g/mol.
Where can I buy Acetylmelodorinol?
You can request a quote for Acetylmelodorinol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Acetylmelodorinol?
Yes, CoreyChem provides custom synthesis services for Acetylmelodorinol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.