![Benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-fluoro- structure](/static/products/1137/113761-79-8.webp)
Benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-fluoro-
TL;DR: Benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-fluoro- (CAS 113761-79-8) is a chemical compound with molecular formula C13H11FN2O5 and molecular weight 294.0652 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-fluorobenzoic acid
Also Known As: Peakdale1_000067, 2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-fluorobenzoic acid, Benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-fluoro-, 2-((4,6-Dimethoxypyrimidin-2-yl)oxy)-6-fluorobenzoic acid, 2-[(4,6-DIMETHOXYPYRIMIDIN-2-YL)OXY]-6-FLUOROBENZOIC ACID
Technical Specifications
| Molecular Formula | C13H11FN2O5 |
| Molecular Weight | 294.0652 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 90.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 294.0652 Da |
| Heavy Atoms | 21 |
| Complexity | 347.0 |
| SMILES | COC1=CC(=NC(=N1)OC2=C(C(=CC=C2)F)C(=O)O)OC |
| InChIKey | OHDXBNAFHWENIQ-UHFFFAOYSA-N |
Chemical Property Profile of Benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-fluoro-
Property Insights of Benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-fluoro-
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-fluoro-. The TPSA of 90.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-fluoro-. Following Lipinski's Rule of Five, Benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-fluoro- has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-fluoro-?
The CAS number of Benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-fluoro- is 113761-79-8.
What is the molecular formula of Benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-fluoro-?
The molecular formula of Benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-fluoro- is C13H11FN2O5.
What is the molecular weight of Benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-fluoro-?
The molecular weight of Benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-fluoro- is 294.0652 g/mol.
Where can I buy Benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-fluoro-?
You can request a quote for Benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-fluoro- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-fluoro-?
Yes, CoreyChem provides custom synthesis services for Benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-fluoro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.