2-(3-Oxo-2-benzofuran-1-ylidene)propanoic acid
TL;DR: 2-(3-Oxo-2-benzofuran-1-ylidene)propanoic acid (CAS 14120-20-8) is a chemical compound with molecular formula C11H8O4 and molecular weight 204.04225 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3-oxo-2-benzofuran-1-ylidene)propanoic acid
Also Known As: 2-(3-oxo-2-benzofuran-1-ylidene)propanoic acid, Propanoic acid, 2-(3-oxo-1(3H)-isobenzofuranylidene)-
Technical Specifications
| Molecular Formula | C11H8O4 |
| Molecular Weight | 204.04225 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 204.04225 Da |
| Heavy Atoms | 15 |
| Complexity | 342.0 |
| SMILES | CC(=C1C2=CC=CC=C2C(=O)O1)C(=O)O |
| InChIKey | FLGWTULNUFEXOJ-UHFFFAOYSA-N |
Chemical Property Profile of 2-(3-Oxo-2-benzofuran-1-ylidene)propanoic acid
Property Insights of 2-(3-Oxo-2-benzofuran-1-ylidene)propanoic acid
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-Oxo-2-benzofuran-1-ylidene)propanoic acid. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-Oxo-2-benzofuran-1-ylidene)propanoic acid. Following Lipinski's Rule of Five, 2-(3-Oxo-2-benzofuran-1-ylidene)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
What is the CAS number of 2-(3-Oxo-2-benzofuran-1-ylidene)propanoic acid?
The CAS number of 2-(3-Oxo-2-benzofuran-1-ylidene)propanoic acid is 14120-20-8.
What is the molecular formula of 2-(3-Oxo-2-benzofuran-1-ylidene)propanoic acid?
The molecular formula of 2-(3-Oxo-2-benzofuran-1-ylidene)propanoic acid is C11H8O4.
What is the molecular weight of 2-(3-Oxo-2-benzofuran-1-ylidene)propanoic acid?
The molecular weight of 2-(3-Oxo-2-benzofuran-1-ylidene)propanoic acid is 204.04225 g/mol.
Where can I buy 2-(3-Oxo-2-benzofuran-1-ylidene)propanoic acid?
You can request a quote for 2-(3-Oxo-2-benzofuran-1-ylidene)propanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(3-Oxo-2-benzofuran-1-ylidene)propanoic acid?
Yes, CoreyChem provides custom synthesis services for 2-(3-Oxo-2-benzofuran-1-ylidene)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.