2-(3-Furanylcarbonyl)benzoic acid
TL;DR: 2-(3-Furanylcarbonyl)benzoic acid (CAS 159618-37-8) is a chemical compound with molecular formula C12H8O4 and molecular weight 216.04225 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(furan-3-carbonyl)benzoic acid
Also Known As: 2-(3-furanoyl)benzoic acid, 2-(furan-3-carbonyl)benzoic Acid, 2-(3-Furanylcarbonyl)benzoic acid
Technical Specifications
| Molecular Formula | C12H8O4 |
| Molecular Weight | 216.04225 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 67.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 216.04225 Da |
| Heavy Atoms | 16 |
| Complexity | 287.0 |
| SMILES | C1=CC=C(C(=C1)C(=O)C2=COC=C2)C(=O)O |
| InChIKey | YXJSZSJNFHHVGH-UHFFFAOYSA-N |
Chemical Property Profile of 2-(3-Furanylcarbonyl)benzoic acid
Property Insights of 2-(3-Furanylcarbonyl)benzoic acid
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-Furanylcarbonyl)benzoic acid. The TPSA of 67.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-Furanylcarbonyl)benzoic acid. Following Lipinski's Rule of Five, 2-(3-Furanylcarbonyl)benzoic 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-Furanylcarbonyl)benzoic acid?
The CAS number of 2-(3-Furanylcarbonyl)benzoic acid is 159618-37-8.
What is the molecular formula of 2-(3-Furanylcarbonyl)benzoic acid?
The molecular formula of 2-(3-Furanylcarbonyl)benzoic acid is C12H8O4.
What is the molecular weight of 2-(3-Furanylcarbonyl)benzoic acid?
The molecular weight of 2-(3-Furanylcarbonyl)benzoic acid is 216.04225 g/mol.
Where can I buy 2-(3-Furanylcarbonyl)benzoic acid?
You can request a quote for 2-(3-Furanylcarbonyl)benzoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(3-Furanylcarbonyl)benzoic acid?
Yes, CoreyChem provides custom synthesis services for 2-(3-Furanylcarbonyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.