2-(2-oxo-2H-chromen-3-yl)benzoic acid
TL;DR: 2-(2-oxo-2H-chromen-3-yl)benzoic acid (CAS 69139-25-9) is a chemical compound with molecular formula C16H10O4 and molecular weight 266.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-oxochromen-3-yl)benzoic acid
Also Known As: 2-(2-oxo-2H-chromen-3-yl)benzoic acid, 2-(2-oxochromen-3-yl)benzoic Acid, J3.701.325K, 2-(2-Oxo-2H-1-benzopyran-3-yl)benzoic acid, AB01329730-02
| Molecular Formula | C16H10O4 |
|---|---|
| Molecular Weight | 266.06 g/mol |
| LogP | 3.1582 |
| Topological Polar Surface Area | 67.51 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 266.05792 |
| Heavy Atoms | 20 |
| Complexity | 861.4799 |
Chemical Identifiers
| CAS Number | 69139-25-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(C(=O)O2)C3=CC=CC=C3C(=O)O |
Product Overview
2-(2-oxo-2H-chromen-3-yl)benzoic acid (CAS 69139-25-9), with molecular formula C16H10O4 and molecular weight 266.06 g/mol. IUPAC: 2-(2-oxochromen-3-yl)benzoic acid.
Chemical Property Profile of 2-(2-oxo-2H-chromen-3-yl)benzoic acid
Property Insights of 2-(2-oxo-2H-chromen-3-yl)benzoic acid
The XLogP value of 3.1582 indicates that 2-(2-oxo-2H-chromen-3-yl)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-oxo-2H-chromen-3-yl)benzoic acid. Following Lipinski's Rule of Five, 2-(2-oxo-2H-chromen-3-yl)benzoic acid has 1 hydrogen bond donor(s) and 3 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-(2-oxo-2H-chromen-3-yl)benzoic acid?
The CAS number of 2-(2-oxo-2H-chromen-3-yl)benzoic acid is 69139-25-9.
What is the molecular formula of 2-(2-oxo-2H-chromen-3-yl)benzoic acid?
The molecular formula of 2-(2-oxo-2H-chromen-3-yl)benzoic acid is C16H10O4.
What is the molecular weight of 2-(2-oxo-2H-chromen-3-yl)benzoic acid?
The molecular weight of 2-(2-oxo-2H-chromen-3-yl)benzoic acid is 266.06 g/mol.
Where can I buy 2-(2-oxo-2H-chromen-3-yl)benzoic acid?
You can request a quote for 2-(2-oxo-2H-chromen-3-yl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-oxo-2H-chromen-3-yl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-oxo-2H-chromen-3-yl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.