![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 294.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
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
| Molecular Formula | C13H11FN2O5 |
|---|---|
| Molecular Weight | 294.07 g/mol |
| LogP | 2.1234 |
| Topological Polar Surface Area | 90.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 294.0652 |
| Heavy Atoms | 21 |
| Complexity | 655.3563 |
Chemical Identifiers
| CAS Number | 113761-79-8 |
|---|---|
| SMILES | COC1=CC(=NC(=N1)OC2=C(C(=CC=C2)F)C(=O)O)OC |
Product Overview
Benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-fluoro- (CAS 113761-79-8), with molecular formula C13H11FN2O5 and molecular weight 294.07 g/mol. IUPAC: 2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-fluorobenzoic acid.
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 2.1234 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-fluoro-. The TPSA of 90.77 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 6 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 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 294.07 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 KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-fluoro-?
Yes, KEHONG BIO 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.