methyl 3-(7-hydroxy-4-methyl-2-oxo-2H-chromen-6-yl)propanoate
TL;DR: methyl 3-(7-hydroxy-4-methyl-2-oxo-2H-chromen-6-yl)propanoate (CAS 890635-31-1) is a chemical compound with molecular formula C14H14O5 and molecular weight 262.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(7-hydroxy-4-methyl-2-oxochromen-6-yl)propanoate
Also Known As: methyl 3-(7-hydroxy-4-methyl-2-oxo-2H-chromen-6-yl)propanoate, methyl 3-(7-hydroxy-4-methyl-2-oxochromen-6-yl)propanoate, VU0606047-1, AB01315659-02, F3228-0185
| Molecular Formula | C14H14O5 |
|---|---|
| Molecular Weight | 262.08 g/mol |
| LogP | 1.91262 |
| Topological Polar Surface Area | 76.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 262.08414 |
| Heavy Atoms | 19 |
| Complexity | 684.0312 |
Chemical Identifiers
| CAS Number | 890635-31-1 |
|---|---|
| SMILES | CC1=CC(=O)OC2=C1C=C(C(=C2)O)CCC(=O)OC |
Product Overview
methyl 3-(7-hydroxy-4-methyl-2-oxo-2H-chromen-6-yl)propanoate (CAS 890635-31-1), with molecular formula C14H14O5 and molecular weight 262.08 g/mol. IUPAC: methyl 3-(7-hydroxy-4-methyl-2-oxochromen-6-yl)propanoate.
Chemical Property Profile of methyl 3-(7-hydroxy-4-methyl-2-oxo-2H-chromen-6-yl)propanoate
Property Insights of methyl 3-(7-hydroxy-4-methyl-2-oxo-2H-chromen-6-yl)propanoate
The XLogP value of 1.91262 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 3-(7-hydroxy-4-methyl-2-oxo-2H-chromen-6-yl)propanoate. The TPSA of 76.74 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 3-(7-hydroxy-4-methyl-2-oxo-2H-chromen-6-yl)propanoate. Following Lipinski's Rule of Five, methyl 3-(7-hydroxy-4-methyl-2-oxo-2H-chromen-6-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 methyl 3-(7-hydroxy-4-methyl-2-oxo-2H-chromen-6-yl)propanoate?
The CAS number of methyl 3-(7-hydroxy-4-methyl-2-oxo-2H-chromen-6-yl)propanoate is 890635-31-1.
What is the molecular formula of methyl 3-(7-hydroxy-4-methyl-2-oxo-2H-chromen-6-yl)propanoate?
The molecular formula of methyl 3-(7-hydroxy-4-methyl-2-oxo-2H-chromen-6-yl)propanoate is C14H14O5.
What is the molecular weight of methyl 3-(7-hydroxy-4-methyl-2-oxo-2H-chromen-6-yl)propanoate?
The molecular weight of methyl 3-(7-hydroxy-4-methyl-2-oxo-2H-chromen-6-yl)propanoate is 262.08 g/mol.
Where can I buy methyl 3-(7-hydroxy-4-methyl-2-oxo-2H-chromen-6-yl)propanoate?
You can request a quote for methyl 3-(7-hydroxy-4-methyl-2-oxo-2H-chromen-6-yl)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 3-(7-hydroxy-4-methyl-2-oxo-2H-chromen-6-yl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 3-(7-hydroxy-4-methyl-2-oxo-2H-chromen-6-yl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.