About 2-(2-chlorophenoxy)-5-(trifluoromethyl)pyridine
2-(2-chlorophenoxy)-5-(trifluoromethyl)pyridine (PubChem CID 894634) has the molecular formula C12H7ClF3NO
and a molecular weight of 273.64 g/mol. Its IUPAC name is 2-(2-chlorophenoxy)-5-(trifluoromethyl)pyridine.
Molecular Properties
| Compound Name | 2-(2-chlorophenoxy)-5-(trifluoromethyl)pyridine |
| PubChem CID | 894634 |
| Molecular Formula | C12H7ClF3NO |
| Molecular Weight | 273.64 g/mol |
| Exact Mass | 273.02 |
| IUPAC Name | 2-(2-chlorophenoxy)-5-(trifluoromethyl)pyridine |
| SMILES | FC(F)(F)c1ccc(Oc2ccccc2Cl)nc1 |
| InChI | InChI=1S/C12H7ClF3NO/c13-9-3-1-2-4-10(9)18-11-6-5-8(7-17-11)12(14,15)16/h1-7H |
| InChIKey | KSEYZBDMMWHPRM-UHFFFAOYSA-N |
| XLogP | 4.55 |
| TPSA | 22.12 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 273.64 |
| LogP ≤ 5 | 4.55 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-(2-chlorophenoxy)-5-(trifluoromethyl)pyridine?
The IUPAC name of 2-(2-chlorophenoxy)-5-(trifluoromethyl)pyridine (CID 894634) is 2-(2-chlorophenoxy)-5-(trifluoromethyl)pyridine.
What is the SMILES notation for 2-(2-chlorophenoxy)-5-(trifluoromethyl)pyridine?
The canonical SMILES for 2-(2-chlorophenoxy)-5-(trifluoromethyl)pyridine is FC(F)(F)c1ccc(Oc2ccccc2Cl)nc1.
What is the InChIKey of 2-(2-chlorophenoxy)-5-(trifluoromethyl)pyridine?
The InChIKey is KSEYZBDMMWHPRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7ClF3NO/c13-9-3-1-2-4-10(9)18-11-6-5-8(7-17-11)12(14,15)16/h1-7H.
What are the key properties of 2-(2-chlorophenoxy)-5-(trifluoromethyl)pyridine?
2-(2-chlorophenoxy)-5-(trifluoromethyl)pyridine has a molecular weight of 273.64 g/mol, XLogP of 4.55, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenoxy)-5-(trifluoromethyl)pyridine is sourced from PubChem (CID 894634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).