![methyl 4-{[4-cyano-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy}benzenecarboxylate structure](/static/products/3184/318469-10-2.webp)
methyl 4-{[4-cyano-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy}benzenecarboxylate
TL;DR: methyl 4-{[4-cyano-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy}benzenecarboxylate (CAS 318469-10-2) is a chemical compound with molecular formula C14H10F3N3O3 and molecular weight 325.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[4-cyano-1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxybenzoate
Also Known As: methyl 4-{[4-cyano-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy}benzenecarboxylate, 5F-377S, methyl 4-{[4-cyano-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy}benzoate, methyl 4-[4-cyano-2-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxybenzoate, Methyl 4-{4-cyano-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yloxy}benzenecarboxylate
| Molecular Formula | C14H10F3N3O3 |
|---|---|
| Molecular Weight | 325.07 g/mol |
| LogP | 2.88948 |
| Topological Polar Surface Area | 77.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 325.0674 |
| Heavy Atoms | 23 |
| Complexity | 773.5359 |
Chemical Identifiers
| CAS Number | 318469-10-2 |
|---|---|
| SMILES | CN1C(=C(C(=N1)C(F)(F)F)C#N)OC2=CC=C(C=C2)C(=O)OC |
Product Overview
methyl 4-{[4-cyano-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy}benzenecarboxylate (CAS 318469-10-2), with molecular formula C14H10F3N3O3 and molecular weight 325.07 g/mol. IUPAC: methyl 4-[4-cyano-1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxybenzoate.
Chemical Property Profile of methyl 4-{[4-cyano-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy}benzenecarboxylate
Property Insights of methyl 4-{[4-cyano-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy}benzenecarboxylate
The XLogP value of 2.88948 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 4-{[4-cyano-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy}benzenecarboxylate. The TPSA of 77.14 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 4-{[4-cyano-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy}benzenecarboxylate. Following Lipinski's Rule of Five, methyl 4-{[4-cyano-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy}benzenecarboxylate has 0 hydrogen bond donor(s) and 5 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 methyl 4-{[4-cyano-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy}benzenecarboxylate?
The CAS number of methyl 4-{[4-cyano-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy}benzenecarboxylate is 318469-10-2.
What is the molecular formula of methyl 4-{[4-cyano-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy}benzenecarboxylate?
The molecular formula of methyl 4-{[4-cyano-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy}benzenecarboxylate is C14H10F3N3O3.
What is the molecular weight of methyl 4-{[4-cyano-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy}benzenecarboxylate?
The molecular weight of methyl 4-{[4-cyano-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy}benzenecarboxylate is 325.07 g/mol.
Where can I buy methyl 4-{[4-cyano-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy}benzenecarboxylate?
You can request a quote for methyl 4-{[4-cyano-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy}benzenecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 4-{[4-cyano-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy}benzenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 4-{[4-cyano-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy}benzenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.