4-(2-oxo-2H-chromen-3-yl)benzoic acid
TL;DR: 4-(2-oxo-2H-chromen-3-yl)benzoic acid (CAS 14071-70-6) is a chemical compound with molecular formula C16H10O4 and molecular weight 266.05792 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(2-oxochromen-3-yl)benzoic acid
Also Known As: 4-(2-oxo-2H-chromen-3-yl)benzoic acid, 4-(2-oxochromen-3-yl)benzoic acid, starbld0027700, 4-(2-Oxo-2H-chromen-3-yl)-benzoic acid, BB 0245746
Technical Specifications
| Molecular Formula | C16H10O4 |
| Molecular Weight | 266.05792 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 266.05792 Da |
| Heavy Atoms | 20 |
| Complexity | 432.0 |
| SMILES | C1=CC=C2C(=C1)C=C(C(=O)O2)C3=CC=C(C=C3)C(=O)O |
| InChIKey | MBBOXTWFFMVNRN-UHFFFAOYSA-N |
Chemical Property Profile of 4-(2-oxo-2H-chromen-3-yl)benzoic acid
Property Insights of 4-(2-oxo-2H-chromen-3-yl)benzoic acid
The XLogP value of 3.1 indicates that 4-(2-oxo-2H-chromen-3-yl)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-oxo-2H-chromen-3-yl)benzoic acid. Following Lipinski's Rule of Five, 4-(2-oxo-2H-chromen-3-yl)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 4-(2-oxo-2H-chromen-3-yl)benzoic acid?
The CAS number of 4-(2-oxo-2H-chromen-3-yl)benzoic acid is 14071-70-6.
What is the molecular formula of 4-(2-oxo-2H-chromen-3-yl)benzoic acid?
The molecular formula of 4-(2-oxo-2H-chromen-3-yl)benzoic acid is C16H10O4.
What is the molecular weight of 4-(2-oxo-2H-chromen-3-yl)benzoic acid?
The molecular weight of 4-(2-oxo-2H-chromen-3-yl)benzoic acid is 266.05792 g/mol.
Where can I buy 4-(2-oxo-2H-chromen-3-yl)benzoic acid?
You can request a quote for 4-(2-oxo-2H-chromen-3-yl)benzoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(2-oxo-2H-chromen-3-yl)benzoic acid?
Yes, CoreyChem provides custom synthesis services for 4-(2-oxo-2H-chromen-3-yl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.