ethyl 3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoate
TL;DR: ethyl 3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoate (CAS 251361-29-2) is a chemical compound with molecular formula C16H18O5 and molecular weight 290.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-(7-hydroxy-4,8-dimethyl-2-oxochromen-3-yl)propanoate
Also Known As: ethyl 3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoate, ethyl 3-(7-hydroxy-4,8-dimethyl-2-oxochromen-3-yl)propanoate, 5-Benzofuranpropanoicacid,7-bromo-2,3-dihydro-,ethyl ester, 2H-1-benzopyran-3-propanoic acid, 7-hydroxy-4,8-dimethyl-2-oxo-, ethyl ester, ethyl 3-(7-hydroxy-4,8-dimethyl-2-oxo-chromen-3-yl)propanoate
| Molecular Formula | C16H18O5 |
|---|---|
| Molecular Weight | 290.12 g/mol |
| LogP | 2.61114 |
| Topological Polar Surface Area | 76.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 290.11542 |
| Heavy Atoms | 21 |
| Complexity | 742.39624 |
Chemical Identifiers
| CAS Number | 251361-29-2 |
|---|---|
| SMILES | CCOC(=O)CCC1=C(C2=C(C(=C(C=C2)O)C)OC1=O)C |
Product Overview
ethyl 3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoate (CAS 251361-29-2), with molecular formula C16H18O5 and molecular weight 290.12 g/mol. IUPAC: ethyl 3-(7-hydroxy-4,8-dimethyl-2-oxochromen-3-yl)propanoate.
Chemical Property Profile of ethyl 3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoate
Property Insights of ethyl 3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoate
The XLogP value of 2.61114 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoate. The TPSA of 76.74 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoate. Following Lipinski's Rule of Five, ethyl 3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoate 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
Frequently Asked Questions
What is the CAS number of ethyl 3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoate?
The CAS number of ethyl 3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoate is 251361-29-2.
What is the molecular formula of ethyl 3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoate?
The molecular formula of ethyl 3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoate is C16H18O5.
What is the molecular weight of ethyl 3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoate?
The molecular weight of ethyl 3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoate is 290.12 g/mol.
Where can I buy ethyl 3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoate?
You can request a quote for ethyl 3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoate 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-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.