Ethyl 2-(8-acetyl-4-methyl-2-oxochromen-7-yl)oxyacetate
TL;DR: Ethyl 2-(8-acetyl-4-methyl-2-oxochromen-7-yl)oxyacetate (CAS 31479-62-6) is a chemical compound with molecular formula C16H16O6 and molecular weight 304.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(8-acetyl-4-methyl-2-oxochromen-7-yl)oxyacetate
Also Known As: J2.993.432K, ethyl 2-(8-acetyl-4-methyl-2-oxochromen-7-yl)oxyacetate, ethyl 2-((8-acetyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetate, ethyl [(8-acetyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetate, ethyl 2-(8-acetyl-4-methyl-2-oxo-2h-chromen-7-yloxy)acetate
| Molecular Formula | C16H16O6 |
|---|---|
| Molecular Weight | 304.09 g/mol |
| LogP | 2.24592 |
| Topological Polar Surface Area | 82.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 304.0947 |
| Heavy Atoms | 22 |
| Complexity | 787.058 |
Chemical Identifiers
| CAS Number | 31479-62-6 |
|---|---|
| SMILES | CCOC(=O)COC1=C(C2=C(C=C1)C(=CC(=O)O2)C)C(=O)C |
Product Overview
Ethyl 2-(8-acetyl-4-methyl-2-oxochromen-7-yl)oxyacetate (CAS 31479-62-6), with molecular formula C16H16O6 and molecular weight 304.09 g/mol. IUPAC: ethyl 2-(8-acetyl-4-methyl-2-oxochromen-7-yl)oxyacetate.
Chemical Property Profile of Ethyl 2-(8-acetyl-4-methyl-2-oxochromen-7-yl)oxyacetate
Property Insights of Ethyl 2-(8-acetyl-4-methyl-2-oxochromen-7-yl)oxyacetate
The XLogP value of 2.24592 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-(8-acetyl-4-methyl-2-oxochromen-7-yl)oxyacetate. The TPSA of 82.81 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-(8-acetyl-4-methyl-2-oxochromen-7-yl)oxyacetate. Following Lipinski's Rule of Five, Ethyl 2-(8-acetyl-4-methyl-2-oxochromen-7-yl)oxyacetate 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 Ethyl 2-(8-acetyl-4-methyl-2-oxochromen-7-yl)oxyacetate?
The CAS number of Ethyl 2-(8-acetyl-4-methyl-2-oxochromen-7-yl)oxyacetate is 31479-62-6.
What is the molecular formula of Ethyl 2-(8-acetyl-4-methyl-2-oxochromen-7-yl)oxyacetate?
The molecular formula of Ethyl 2-(8-acetyl-4-methyl-2-oxochromen-7-yl)oxyacetate is C16H16O6.
What is the molecular weight of Ethyl 2-(8-acetyl-4-methyl-2-oxochromen-7-yl)oxyacetate?
The molecular weight of Ethyl 2-(8-acetyl-4-methyl-2-oxochromen-7-yl)oxyacetate is 304.09 g/mol.
Where can I buy Ethyl 2-(8-acetyl-4-methyl-2-oxochromen-7-yl)oxyacetate?
You can request a quote for Ethyl 2-(8-acetyl-4-methyl-2-oxochromen-7-yl)oxyacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-(8-acetyl-4-methyl-2-oxochromen-7-yl)oxyacetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(8-acetyl-4-methyl-2-oxochromen-7-yl)oxyacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.