About 2-(4-bromo-2-chlorophenoxy)-6-chloropyrazine
2-(4-bromo-2-chlorophenoxy)-6-chloropyrazine (PubChem CID 60707984) has the molecular formula C10H5BrCl2N2O
and a molecular weight of 319.97 g/mol. Its IUPAC name is 2-(4-bromo-2-chlorophenoxy)-6-chloropyrazine.
Molecular Properties
| Compound Name | 2-(4-bromo-2-chlorophenoxy)-6-chloropyrazine |
| PubChem CID | 60707984 |
| Molecular Formula | C10H5BrCl2N2O |
| Molecular Weight | 319.97 g/mol |
| Exact Mass | 317.90 |
| IUPAC Name | 2-(4-bromo-2-chlorophenoxy)-6-chloropyrazine |
| SMILES | Clc1cncc(Oc2ccc(Br)cc2Cl)n1 |
| InChI | InChI=1S/C10H5BrCl2N2O/c11-6-1-2-8(7(12)3-6)16-10-5-14-4-9(13)15-10/h1-5H |
| InChIKey | UASMDXVRVFVQFD-UHFFFAOYSA-N |
| XLogP | 4.34 |
| TPSA | 35.01 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 319.97 |
| LogP ≤ 5 | 4.34 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-(4-bromo-2-chlorophenoxy)-6-chloropyrazine?
The IUPAC name of 2-(4-bromo-2-chlorophenoxy)-6-chloropyrazine (CID 60707984) is 2-(4-bromo-2-chlorophenoxy)-6-chloropyrazine.
What is the SMILES notation for 2-(4-bromo-2-chlorophenoxy)-6-chloropyrazine?
The canonical SMILES for 2-(4-bromo-2-chlorophenoxy)-6-chloropyrazine is Clc1cncc(Oc2ccc(Br)cc2Cl)n1.
What is the InChIKey of 2-(4-bromo-2-chlorophenoxy)-6-chloropyrazine?
The InChIKey is UASMDXVRVFVQFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H5BrCl2N2O/c11-6-1-2-8(7(12)3-6)16-10-5-14-4-9(13)15-10/h1-5H.
What are the key properties of 2-(4-bromo-2-chlorophenoxy)-6-chloropyrazine?
2-(4-bromo-2-chlorophenoxy)-6-chloropyrazine has a molecular weight of 319.97 g/mol, XLogP of 4.34, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromo-2-chlorophenoxy)-6-chloropyrazine is sourced from PubChem (CID 60707984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).