About 2-(3-bromo-4-fluorophenoxy)-3-chloropyridine
2-(3-bromo-4-fluorophenoxy)-3-chloropyridine (PubChem CID 83234949) has the molecular formula C11H6BrClFNO
and a molecular weight of 302.53 g/mol. Its IUPAC name is 2-(3-bromo-4-fluorophenoxy)-3-chloropyridine.
Molecular Properties
| Compound Name | 2-(3-bromo-4-fluorophenoxy)-3-chloropyridine |
| PubChem CID | 83234949 |
| Molecular Formula | C11H6BrClFNO |
| Molecular Weight | 302.53 g/mol |
| Exact Mass | 300.93 |
| IUPAC Name | 2-(3-bromo-4-fluorophenoxy)-3-chloropyridine |
| SMILES | Fc1ccc(Oc2ncccc2Cl)cc1Br |
| InChI | InChI=1S/C11H6BrClFNO/c12-8-6-7(3-4-10(8)14)16-11-9(13)2-1-5-15-11/h1-6H |
| InChIKey | WUQBMZULEXSPRU-UHFFFAOYSA-N |
| XLogP | 4.43 |
| TPSA | 22.12 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 302.53 |
| LogP ≤ 5 | 4.43 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-(3-bromo-4-fluorophenoxy)-3-chloropyridine?
The IUPAC name of 2-(3-bromo-4-fluorophenoxy)-3-chloropyridine (CID 83234949) is 2-(3-bromo-4-fluorophenoxy)-3-chloropyridine.
What is the SMILES notation for 2-(3-bromo-4-fluorophenoxy)-3-chloropyridine?
The canonical SMILES for 2-(3-bromo-4-fluorophenoxy)-3-chloropyridine is Fc1ccc(Oc2ncccc2Cl)cc1Br.
What is the InChIKey of 2-(3-bromo-4-fluorophenoxy)-3-chloropyridine?
The InChIKey is WUQBMZULEXSPRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6BrClFNO/c12-8-6-7(3-4-10(8)14)16-11-9(13)2-1-5-15-11/h1-6H.
What are the key properties of 2-(3-bromo-4-fluorophenoxy)-3-chloropyridine?
2-(3-bromo-4-fluorophenoxy)-3-chloropyridine has a molecular weight of 302.53 g/mol, XLogP of 4.43, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromo-4-fluorophenoxy)-3-chloropyridine is sourced from PubChem (CID 83234949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).