3-(7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid
TL;DR: 3-(7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid (CAS 708229-45-2) 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.
3-(7-butoxy-4-methyl-2-oxochromen-3-yl)propanoic acid
Also Known As: 3-(7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid, 3-(7-butoxy-4-methyl-2-oxochromen-3-yl)propanoic acid, 3-(7-butoxy-4-methyl-2-oxo-chromen-3-yl)propanoic Acid
| Molecular Formula | C17H20O5 |
|---|---|
| Molecular Weight | 304.13 g/mol |
| LogP | 3.29752 |
| Topological Polar Surface Area | 76.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 304.13107 |
| Heavy Atoms | 22 |
| Complexity | 729.6421 |
Chemical Identifiers
| CAS Number | 708229-45-2 |
|---|---|
| SMILES | CCCCOC1=CC2=C(C=C1)C(=C(C(=O)O2)CCC(=O)O)C |
Product Overview
3-(7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid (CAS 708229-45-2), with molecular formula C17H20O5 and molecular weight 304.13 g/mol. IUPAC: 3-(7-butoxy-4-methyl-2-oxochromen-3-yl)propanoic acid.
Chemical Property Profile of 3-(7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid
Property Insights of 3-(7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid
The XLogP value of 3.29752 indicates that 3-(7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid. Following Lipinski's Rule of Five, 3-(7-butoxy-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-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid?
The CAS number of 3-(7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid is 708229-45-2.
What is the molecular formula of 3-(7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid?
The molecular formula of 3-(7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid is C17H20O5.
What is the molecular weight of 3-(7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid?
The molecular weight of 3-(7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid is 304.13 g/mol.
Where can I buy 3-(7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid?
You can request a quote for 3-(7-butoxy-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-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.