![2-[(4-methyl-2-oxo-2H-chromen-6-yl)oxy]propanoic acid structure](/static/products/960/96078-22-7.png)
2-[(4-methyl-2-oxo-2H-chromen-6-yl)oxy]propanoic acid
TL;DR: 2-[(4-methyl-2-oxo-2H-chromen-6-yl)oxy]propanoic acid (CAS 96078-22-7) is a chemical compound with molecular formula C13H12O5 and molecular weight 248.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methyl-2-oxochromen-6-yl)oxypropanoic acid
Also Known As: 2-[(4-methyl-2-oxo-2H-chromen-6-yl)oxy]propanoic acid, 2-[ oxy]propanoicacid, 2-(4-methyl-2-oxochromen-6-yl)oxypropanoic acid, AO-375/14491103, 2-((4-Methyl-2-oxo-2H-chromen-6-yl)oxy)propanoic acid
| Molecular Formula | C13H12O5 |
|---|---|
| Molecular Weight | 248.07 g/mol |
| LogP | 1.95332 |
| Topological Polar Surface Area | 76.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 248.06847 |
| Heavy Atoms | 18 |
| Complexity | 655.9695 |
Chemical Identifiers
| CAS Number | 96078-22-7 |
|---|---|
| SMILES | CC1=CC(=O)OC2=C1C=C(C=C2)OC(C)C(=O)O |
Product Overview
2-[(4-methyl-2-oxo-2H-chromen-6-yl)oxy]propanoic acid (CAS 96078-22-7), with molecular formula C13H12O5 and molecular weight 248.07 g/mol. IUPAC: 2-(4-methyl-2-oxochromen-6-yl)oxypropanoic acid.
Chemical Property Profile of 2-[(4-methyl-2-oxo-2H-chromen-6-yl)oxy]propanoic acid
Property Insights of 2-[(4-methyl-2-oxo-2H-chromen-6-yl)oxy]propanoic acid
The XLogP value of 1.95332 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(4-methyl-2-oxo-2H-chromen-6-yl)oxy]propanoic acid. The TPSA of 76.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(4-methyl-2-oxo-2H-chromen-6-yl)oxy]propanoic acid. Following Lipinski's Rule of Five, 2-[(4-methyl-2-oxo-2H-chromen-6-yl)oxy]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 2-[(4-methyl-2-oxo-2H-chromen-6-yl)oxy]propanoic acid?
The CAS number of 2-[(4-methyl-2-oxo-2H-chromen-6-yl)oxy]propanoic acid is 96078-22-7.
What is the molecular formula of 2-[(4-methyl-2-oxo-2H-chromen-6-yl)oxy]propanoic acid?
The molecular formula of 2-[(4-methyl-2-oxo-2H-chromen-6-yl)oxy]propanoic acid is C13H12O5.
What is the molecular weight of 2-[(4-methyl-2-oxo-2H-chromen-6-yl)oxy]propanoic acid?
The molecular weight of 2-[(4-methyl-2-oxo-2H-chromen-6-yl)oxy]propanoic acid is 248.07 g/mol.
Where can I buy 2-[(4-methyl-2-oxo-2H-chromen-6-yl)oxy]propanoic acid?
You can request a quote for 2-[(4-methyl-2-oxo-2H-chromen-6-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-methyl-2-oxo-2H-chromen-6-yl)oxy]propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-methyl-2-oxo-2H-chromen-6-yl)oxy]propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.