2-(3-Methoxy-4-oxo-2-phenyl-4H-1-benzopyran-6-yl)butanoic acid
TL;DR: 2-(3-Methoxy-4-oxo-2-phenyl-4H-1-benzopyran-6-yl)butanoic acid (CAS 173469-87-9) is a chemical compound with molecular formula C20H18O5 and molecular weight 338.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-methoxy-4-oxo-2-phenylchromen-6-yl)butanoic acid
Also Known As: 2-(3-Methoxy-2-phenylchromon-6-yl)butanoic acid, alpha-Ethyl-3-methoxy-4-oxo-2-phenyl-4H-1-benzopyran-6-acetic acid, 4H-1-Benzopyran-6-acetic acid, alpha-ethyl-3-methoxy-4-oxo-2-phenyl-, 2-(3-Methoxy-4-oxo-2-phenyl-4H-1-benzopyran-6-yl)butanoic acid, 2-(3-methoxy-4-oxo-2-phenylchromen-6-yl)butanoic acid
| Molecular Formula | C20H18O5 |
|---|---|
| Molecular Weight | 338.12 g/mol |
| LogP | 4.0468 |
| Topological Polar Surface Area | 76.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 338.11542 |
| Heavy Atoms | 25 |
| Complexity | 972.5382 |
Chemical Identifiers
| CAS Number | 173469-87-9 |
|---|---|
| SMILES | CCC(C1=CC2=C(C=C1)OC(=C(C2=O)OC)C3=CC=CC=C3)C(=O)O |
Product Overview
2-(3-Methoxy-4-oxo-2-phenyl-4H-1-benzopyran-6-yl)butanoic acid (CAS 173469-87-9), with molecular formula C20H18O5 and molecular weight 338.12 g/mol. IUPAC: 2-(3-methoxy-4-oxo-2-phenylchromen-6-yl)butanoic acid.
Chemical Property Profile of 2-(3-Methoxy-4-oxo-2-phenyl-4H-1-benzopyran-6-yl)butanoic acid
Property Insights of 2-(3-Methoxy-4-oxo-2-phenyl-4H-1-benzopyran-6-yl)butanoic acid
The XLogP value of 4.0468 indicates that 2-(3-Methoxy-4-oxo-2-phenyl-4H-1-benzopyran-6-yl)butanoic 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 2-(3-Methoxy-4-oxo-2-phenyl-4H-1-benzopyran-6-yl)butanoic acid. Following Lipinski's Rule of Five, 2-(3-Methoxy-4-oxo-2-phenyl-4H-1-benzopyran-6-yl)butanoic 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 2-(3-Methoxy-4-oxo-2-phenyl-4H-1-benzopyran-6-yl)butanoic acid?
The CAS number of 2-(3-Methoxy-4-oxo-2-phenyl-4H-1-benzopyran-6-yl)butanoic acid is 173469-87-9.
What is the molecular formula of 2-(3-Methoxy-4-oxo-2-phenyl-4H-1-benzopyran-6-yl)butanoic acid?
The molecular formula of 2-(3-Methoxy-4-oxo-2-phenyl-4H-1-benzopyran-6-yl)butanoic acid is C20H18O5.
What is the molecular weight of 2-(3-Methoxy-4-oxo-2-phenyl-4H-1-benzopyran-6-yl)butanoic acid?
The molecular weight of 2-(3-Methoxy-4-oxo-2-phenyl-4H-1-benzopyran-6-yl)butanoic acid is 338.12 g/mol.
Where can I buy 2-(3-Methoxy-4-oxo-2-phenyl-4H-1-benzopyran-6-yl)butanoic acid?
You can request a quote for 2-(3-Methoxy-4-oxo-2-phenyl-4H-1-benzopyran-6-yl)butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-Methoxy-4-oxo-2-phenyl-4H-1-benzopyran-6-yl)butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Methoxy-4-oxo-2-phenyl-4H-1-benzopyran-6-yl)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.