ethyl 3-(7-acetoxy-2-oxo-2H-chromen-3-yl)-3-oxopropanoate
TL;DR: ethyl 3-(7-acetoxy-2-oxo-2H-chromen-3-yl)-3-oxopropanoate (CAS 313550-40-2) is a chemical compound with molecular formula C16H14O7 and molecular weight 318.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-(7-acetyloxy-2-oxochromen-3-yl)-3-oxopropanoate
Also Known As: ethyl 3-(7-acetyloxy-2-oxochromen-3-yl)-3-oxopropanoate, ethyl 3-(7-acetoxy-2-oxo-2H-chromen-3-yl)-3-oxopropanoate, ethyl 3-[7-(acetyloxy)-2-oxo-2H-chromen-3-yl]-3-oxopropanoate
| Molecular Formula | C16H14O7 |
|---|---|
| Molecular Weight | 318.07 g/mol |
| LogP | 1.8542 |
| Topological Polar Surface Area | 99.88 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 318.07394 |
| Heavy Atoms | 23 |
| Complexity | 831.9279 |
Chemical Identifiers
| CAS Number | 313550-40-2 |
|---|---|
| SMILES | CCOC(=O)CC(=O)C1=CC2=C(C=C(C=C2)OC(=O)C)OC1=O |
Product Overview
ethyl 3-(7-acetoxy-2-oxo-2H-chromen-3-yl)-3-oxopropanoate (CAS 313550-40-2), with molecular formula C16H14O7 and molecular weight 318.07 g/mol. IUPAC: ethyl 3-(7-acetyloxy-2-oxochromen-3-yl)-3-oxopropanoate.
Chemical Property Profile of ethyl 3-(7-acetoxy-2-oxo-2H-chromen-3-yl)-3-oxopropanoate
Property Insights of ethyl 3-(7-acetoxy-2-oxo-2H-chromen-3-yl)-3-oxopropanoate
The XLogP value of 1.8542 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 3-(7-acetoxy-2-oxo-2H-chromen-3-yl)-3-oxopropanoate. The TPSA of 99.88 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 3-(7-acetoxy-2-oxo-2H-chromen-3-yl)-3-oxopropanoate. Following Lipinski's Rule of Five, ethyl 3-(7-acetoxy-2-oxo-2H-chromen-3-yl)-3-oxopropanoate has 0 hydrogen bond donor(s) and 7 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 3-(7-acetoxy-2-oxo-2H-chromen-3-yl)-3-oxopropanoate?
The CAS number of ethyl 3-(7-acetoxy-2-oxo-2H-chromen-3-yl)-3-oxopropanoate is 313550-40-2.
What is the molecular formula of ethyl 3-(7-acetoxy-2-oxo-2H-chromen-3-yl)-3-oxopropanoate?
The molecular formula of ethyl 3-(7-acetoxy-2-oxo-2H-chromen-3-yl)-3-oxopropanoate is C16H14O7.
What is the molecular weight of ethyl 3-(7-acetoxy-2-oxo-2H-chromen-3-yl)-3-oxopropanoate?
The molecular weight of ethyl 3-(7-acetoxy-2-oxo-2H-chromen-3-yl)-3-oxopropanoate is 318.07 g/mol.
Where can I buy ethyl 3-(7-acetoxy-2-oxo-2H-chromen-3-yl)-3-oxopropanoate?
You can request a quote for ethyl 3-(7-acetoxy-2-oxo-2H-chromen-3-yl)-3-oxopropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 3-(7-acetoxy-2-oxo-2H-chromen-3-yl)-3-oxopropanoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 3-(7-acetoxy-2-oxo-2H-chromen-3-yl)-3-oxopropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.