3-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid
TL;DR: 3-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid (CAS 858744-13-5) 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.
3-(7-methoxy-4-methyl-2-oxochromen-3-yl)propanoic acid
Also Known As: 3-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid, 3-(7-methoxy-4-methyl-2-oxochromen-3-yl)propanoic acid, 3-(7-methoxy-4-methyl-2-oxo-chromen-3-yl)propanoic Acid, 2H-1-Benzopyran-3-propanoic acid, 7-methoxy-4-methyl-2-oxo-, 3-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoicacid
| Molecular Formula | C14H14O5 |
|---|---|
| Molecular Weight | 262.08 g/mol |
| LogP | 2.12722 |
| Topological Polar Surface Area | 76.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 262.08414 |
| Heavy Atoms | 19 |
| Complexity | 684.0312 |
Chemical Identifiers
| CAS Number | 858744-13-5 |
|---|---|
| SMILES | CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)O |
Product Overview
3-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid (CAS 858744-13-5), with molecular formula C14H14O5 and molecular weight 262.08 g/mol. IUPAC: 3-(7-methoxy-4-methyl-2-oxochromen-3-yl)propanoic acid.
Chemical Property Profile of 3-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid
Property Insights of 3-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid
The XLogP value of 2.12722 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid. The TPSA of 76.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid. Following Lipinski's Rule of Five, 3-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid has 1 hydrogen bond donor(s) and 4 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 3-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid?
The CAS number of 3-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid is 858744-13-5.
What is the molecular formula of 3-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid?
The molecular formula of 3-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid is C14H14O5.
What is the molecular weight of 3-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid?
The molecular weight of 3-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid is 262.08 g/mol.
Where can I buy 3-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid?
You can request a quote for 3-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.