Ethyl 5-(2-Fluoro-4-methoxyphenyl)-1H-pyrazole-3-carboxylate
TL;DR: Ethyl 5-(2-Fluoro-4-methoxyphenyl)-1H-pyrazole-3-carboxylate (CAS 1046454-77-6) is a chemical compound with molecular formula C13H13FN2O3 and molecular weight 264.09103 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 3-(2-fluoro-4-methoxyphenyl)-1H-pyrazole-5-carboxylate
Also Known As: ethyl 3-(2-fluoro-4-methoxyphenyl)-1H-pyrazole-5-carboxylate, Ethyl 5-(2-Fluoro-4-methoxyphenyl)-1H-pyrazole-3-carboxylate
Technical Specifications
| Molecular Formula | C13H13FN2O3 |
| Molecular Weight | 264.09103 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 64.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 264.09103 Da |
| Heavy Atoms | 19 |
| Complexity | 316.0 |
| SMILES | CCOC(=O)C1=CC(=NN1)C2=C(C=C(C=C2)OC)F |
| InChIKey | KUSGWWKKAGKKGD-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl 5-(2-Fluoro-4-methoxyphenyl)-1H-pyrazole-3-carboxylate
Property Insights of Ethyl 5-(2-Fluoro-4-methoxyphenyl)-1H-pyrazole-3-carboxylate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 5-(2-Fluoro-4-methoxyphenyl)-1H-pyrazole-3-carboxylate. The TPSA of 64.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 5-(2-Fluoro-4-methoxyphenyl)-1H-pyrazole-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 5-(2-Fluoro-4-methoxyphenyl)-1H-pyrazole-3-carboxylate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ethyl 5-(2-Fluoro-4-methoxyphenyl)-1H-pyrazole-3-carboxylate?
The CAS number of Ethyl 5-(2-Fluoro-4-methoxyphenyl)-1H-pyrazole-3-carboxylate is 1046454-77-6.
What is the molecular formula of Ethyl 5-(2-Fluoro-4-methoxyphenyl)-1H-pyrazole-3-carboxylate?
The molecular formula of Ethyl 5-(2-Fluoro-4-methoxyphenyl)-1H-pyrazole-3-carboxylate is C13H13FN2O3.
What is the molecular weight of Ethyl 5-(2-Fluoro-4-methoxyphenyl)-1H-pyrazole-3-carboxylate?
The molecular weight of Ethyl 5-(2-Fluoro-4-methoxyphenyl)-1H-pyrazole-3-carboxylate is 264.09103 g/mol.
Where can I buy Ethyl 5-(2-Fluoro-4-methoxyphenyl)-1H-pyrazole-3-carboxylate?
You can request a quote for Ethyl 5-(2-Fluoro-4-methoxyphenyl)-1H-pyrazole-3-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 5-(2-Fluoro-4-methoxyphenyl)-1H-pyrazole-3-carboxylate?
Yes, CoreyChem provides custom synthesis services for Ethyl 5-(2-Fluoro-4-methoxyphenyl)-1H-pyrazole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.