About 3-bromo-2-(5-bromo-2-fluorophenoxy)pyridine
3-bromo-2-(5-bromo-2-fluorophenoxy)pyridine (PubChem CID 114673272) has the molecular formula C11H6Br2FNO
and a molecular weight of 346.98 g/mol. Its IUPAC name is 3-bromo-2-(5-bromo-2-fluorophenoxy)pyridine.
Molecular Properties
| Compound Name | 3-bromo-2-(5-bromo-2-fluorophenoxy)pyridine |
| PubChem CID | 114673272 |
| Molecular Formula | C11H6Br2FNO |
| Molecular Weight | 346.98 g/mol |
| Exact Mass | 344.88 |
| IUPAC Name | 3-bromo-2-(5-bromo-2-fluorophenoxy)pyridine |
| SMILES | Fc1ccc(Br)cc1Oc1ncccc1Br |
| InChI | InChI=1S/C11H6Br2FNO/c12-7-3-4-9(14)10(6-7)16-11-8(13)2-1-5-15-11/h1-6H |
| InChIKey | FWHGWSUBEHTMKV-UHFFFAOYSA-N |
| XLogP | 4.54 |
| 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 | 346.98 |
| LogP ≤ 5 | 4.54 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 3-bromo-2-(5-bromo-2-fluorophenoxy)pyridine?
The IUPAC name of 3-bromo-2-(5-bromo-2-fluorophenoxy)pyridine (CID 114673272) is 3-bromo-2-(5-bromo-2-fluorophenoxy)pyridine.
What is the SMILES notation for 3-bromo-2-(5-bromo-2-fluorophenoxy)pyridine?
The canonical SMILES for 3-bromo-2-(5-bromo-2-fluorophenoxy)pyridine is Fc1ccc(Br)cc1Oc1ncccc1Br.
What is the InChIKey of 3-bromo-2-(5-bromo-2-fluorophenoxy)pyridine?
The InChIKey is FWHGWSUBEHTMKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6Br2FNO/c12-7-3-4-9(14)10(6-7)16-11-8(13)2-1-5-15-11/h1-6H.
What are the key properties of 3-bromo-2-(5-bromo-2-fluorophenoxy)pyridine?
3-bromo-2-(5-bromo-2-fluorophenoxy)pyridine has a molecular weight of 346.98 g/mol, XLogP of 4.54, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-2-(5-bromo-2-fluorophenoxy)pyridine is sourced from PubChem (CID 114673272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).