About 2-(5-bromothiophen-2-yl)-5-phenylfuran
2-(5-bromothiophen-2-yl)-5-phenylfuran (PubChem CID 122234638) has the molecular formula C14H9BrOS
and a molecular weight of 305.20 g/mol. Its IUPAC name is 2-(5-bromothiophen-2-yl)-5-phenylfuran.
Molecular Properties
| Compound Name | 2-(5-bromothiophen-2-yl)-5-phenylfuran |
| PubChem CID | 122234638 |
| Molecular Formula | C14H9BrOS |
| Molecular Weight | 305.20 g/mol |
| Exact Mass | 303.96 |
| IUPAC Name | 2-(5-bromothiophen-2-yl)-5-phenylfuran |
| SMILES | Brc1ccc(-c2ccc(-c3ccccc3)o2)s1 |
| InChI | InChI=1S/C14H9BrOS/c15-14-9-8-13(17-14)12-7-6-11(16-12)10-4-2-1-3-5-10/h1-9H |
| InChIKey | DENUIMMPQMDDDY-UHFFFAOYSA-N |
| XLogP | 5.44 |
| TPSA | 13.14 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 305.20 |
| LogP ≤ 5 | 5.44 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-(5-bromothiophen-2-yl)-5-phenylfuran?
The IUPAC name of 2-(5-bromothiophen-2-yl)-5-phenylfuran (CID 122234638) is 2-(5-bromothiophen-2-yl)-5-phenylfuran.
What is the SMILES notation for 2-(5-bromothiophen-2-yl)-5-phenylfuran?
The canonical SMILES for 2-(5-bromothiophen-2-yl)-5-phenylfuran is Brc1ccc(-c2ccc(-c3ccccc3)o2)s1.
What is the InChIKey of 2-(5-bromothiophen-2-yl)-5-phenylfuran?
The InChIKey is DENUIMMPQMDDDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9BrOS/c15-14-9-8-13(17-14)12-7-6-11(16-12)10-4-2-1-3-5-10/h1-9H.
What are the key properties of 2-(5-bromothiophen-2-yl)-5-phenylfuran?
2-(5-bromothiophen-2-yl)-5-phenylfuran has a molecular weight of 305.20 g/mol, XLogP of 5.44, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromothiophen-2-yl)-5-phenylfuran is sourced from PubChem (CID 122234638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).