![2-[(4-butyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]propanoic acid structure](/static/products/843/843620-39-3.png)
2-[(4-butyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]propanoic acid
TL;DR: 2-[(4-butyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]propanoic acid (CAS 843620-39-3) is a chemical compound with molecular formula C17H20O5 and molecular weight 304.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-butyl-7-methyl-2-oxochromen-5-yl)oxypropanoic acid
Also Known As: 2-[(4-butyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]propanoic acid, 2-(4-butyl-7-methyl-2-oxochromen-5-yl)oxypropanoic acid, 2-((4-Butyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy)propanoic acid, 2-(4-butyl-2-keto-7-methyl-chromen-5-yl)oxypropionic acid, 2-(4-butyl-7-methyl-2-oxo-chromen-5-yl)oxypropanoic acid
| Molecular Formula | C17H20O5 |
|---|---|
| Molecular Weight | 304.13 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 72.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 304.13107 |
| Heavy Atoms | 22 |
| Complexity | 456.0 |
Chemical Identifiers
| CAS Number | 843620-39-3 |
|---|---|
| SMILES | CCCCC1=CC(=O)OC2=C1C(=CC(=C2)C)OC(C)C(=O)O |
| InChIKey | CQMKXRSRPTYYJJ-UHFFFAOYSA-N |
Product Overview
2-[(4-butyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]propanoic acid (CAS 843620-39-3), with molecular formula C17H20O5 and molecular weight 304.13 g/mol. IUPAC: 2-(4-butyl-7-methyl-2-oxochromen-5-yl)oxypropanoic acid.
Chemical Property Profile of 2-[(4-butyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]propanoic acid
Property Insights of 2-[(4-butyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]propanoic acid
The XLogP value of 3.7 indicates that 2-[(4-butyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]propanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(4-butyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]propanoic acid. Following Lipinski's Rule of Five, 2-[(4-butyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]propanoic acid 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 2-[(4-butyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]propanoic acid?
The CAS number of 2-[(4-butyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]propanoic acid is 843620-39-3.
What is the molecular formula of 2-[(4-butyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]propanoic acid?
The molecular formula of 2-[(4-butyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]propanoic acid is C17H20O5.
What is the molecular weight of 2-[(4-butyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]propanoic acid?
The molecular weight of 2-[(4-butyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]propanoic acid is 304.13 g/mol.
Where can I buy 2-[(4-butyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]propanoic acid?
You can request a quote for 2-[(4-butyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-butyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-butyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.