methyl (7-hydroxy-8-methyl-2-oxo-2H-chromen-4-yl)acetate
TL;DR: methyl (7-hydroxy-8-methyl-2-oxo-2H-chromen-4-yl)acetate (CAS 714206-31-2) is a chemical compound with molecular formula C13H12O5 and molecular weight 248.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(7-hydroxy-8-methyl-2-oxochromen-4-yl)acetate
Also Known As: methyl (7-hydroxy-8-methyl-2-oxo-2H-chromen-4-yl)acetate, Methyl 2-(7-hydroxy-8-methyl-2-oxo-2H-chromen-4-yl)acetate, methyl 2-(7-hydroxy-8-methyl-2-oxochromen-4-yl)acetate, Methyl (7-hydroxy-8-methyl-2-oxo-2H-chromen-4-yl)-acetate, methyl 2-(7-hydroxy-8-methyl-2-oxo-chromen-4-yl)acetate
| Molecular Formula | C13H12O5 |
|---|---|
| Molecular Weight | 248.07 g/mol |
| LogP | 1.52252 |
| Topological Polar Surface Area | 76.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.06847 |
| Heavy Atoms | 18 |
| Complexity | 668.87134 |
Chemical Identifiers
| CAS Number | 714206-31-2 |
|---|---|
| SMILES | CC1=C(C=CC2=C1OC(=O)C=C2CC(=O)OC)O |
Product Overview
methyl (7-hydroxy-8-methyl-2-oxo-2H-chromen-4-yl)acetate (CAS 714206-31-2), with molecular formula C13H12O5 and molecular weight 248.07 g/mol. IUPAC: methyl 2-(7-hydroxy-8-methyl-2-oxochromen-4-yl)acetate.
Chemical Property Profile of methyl (7-hydroxy-8-methyl-2-oxo-2H-chromen-4-yl)acetate
Property Insights of methyl (7-hydroxy-8-methyl-2-oxo-2H-chromen-4-yl)acetate
The XLogP value of 1.52252 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl (7-hydroxy-8-methyl-2-oxo-2H-chromen-4-yl)acetate. The TPSA of 76.74 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl (7-hydroxy-8-methyl-2-oxo-2H-chromen-4-yl)acetate. Following Lipinski's Rule of Five, methyl (7-hydroxy-8-methyl-2-oxo-2H-chromen-4-yl)acetate 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 methyl (7-hydroxy-8-methyl-2-oxo-2H-chromen-4-yl)acetate?
The CAS number of methyl (7-hydroxy-8-methyl-2-oxo-2H-chromen-4-yl)acetate is 714206-31-2.
What is the molecular formula of methyl (7-hydroxy-8-methyl-2-oxo-2H-chromen-4-yl)acetate?
The molecular formula of methyl (7-hydroxy-8-methyl-2-oxo-2H-chromen-4-yl)acetate is C13H12O5.
What is the molecular weight of methyl (7-hydroxy-8-methyl-2-oxo-2H-chromen-4-yl)acetate?
The molecular weight of methyl (7-hydroxy-8-methyl-2-oxo-2H-chromen-4-yl)acetate is 248.07 g/mol.
Where can I buy methyl (7-hydroxy-8-methyl-2-oxo-2H-chromen-4-yl)acetate?
You can request a quote for methyl (7-hydroxy-8-methyl-2-oxo-2H-chromen-4-yl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl (7-hydroxy-8-methyl-2-oxo-2H-chromen-4-yl)acetate?
Yes, KEHONG BIO provides custom synthesis services for methyl (7-hydroxy-8-methyl-2-oxo-2H-chromen-4-yl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.