3-quinolin-6-ylbenzoic Acid
TL;DR: 3-quinolin-6-ylbenzoic Acid (CAS 1023531-22-7) is a chemical compound with molecular formula C16H11NO2 and molecular weight 249.07898 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-quinolin-6-ylbenzoic acid
Also Known As: 3-quinolin-6-ylbenzoic Acid, 3-(6-Quinolinyl)benzoic acid, 3-(Quinolin-6-yl)benzoic acid, Q92
Technical Specifications
| Molecular Formula | C16H11NO2 |
| Molecular Weight | 249.07898 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 50.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 249.07898 Da |
| Heavy Atoms | 19 |
| Complexity | 331.0 |
| SMILES | C1=CC(=CC(=C1)C(=O)O)C2=CC3=C(C=C2)N=CC=C3 |
| InChIKey | NVUDTXCAUAPCDL-UHFFFAOYSA-N |
Chemical Property Profile of 3-quinolin-6-ylbenzoic Acid
Property Insights of 3-quinolin-6-ylbenzoic Acid
The XLogP value of 3.4 indicates that 3-quinolin-6-ylbenzoic Acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.2 Ų, 3-quinolin-6-ylbenzoic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-quinolin-6-ylbenzoic 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
What is the CAS number of 3-quinolin-6-ylbenzoic Acid?
The CAS number of 3-quinolin-6-ylbenzoic Acid is 1023531-22-7.
What is the molecular formula of 3-quinolin-6-ylbenzoic Acid?
The molecular formula of 3-quinolin-6-ylbenzoic Acid is C16H11NO2.
What is the molecular weight of 3-quinolin-6-ylbenzoic Acid?
The molecular weight of 3-quinolin-6-ylbenzoic Acid is 249.07898 g/mol.
Where can I buy 3-quinolin-6-ylbenzoic Acid?
You can request a quote for 3-quinolin-6-ylbenzoic Acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-quinolin-6-ylbenzoic Acid?
Yes, CoreyChem provides custom synthesis services for 3-quinolin-6-ylbenzoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.