About 2,5,6-tribromothieno[3,2-b]thiophene
2,5,6-tribromothieno[3,2-b]thiophene (PubChem CID 1211733) has the molecular formula C6HBr3S2
and a molecular weight of 376.92 g/mol. Its IUPAC name is 2,5,6-tribromothieno[3,2-b]thiophene.
Molecular Properties
| Compound Name | 2,5,6-tribromothieno[3,2-b]thiophene |
|---|
| PubChem CID | 1211733 |
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| Molecular Formula | C6HBr3S2 |
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| Molecular Weight | 376.92 g/mol |
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| Exact Mass | 373.71 |
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| IUPAC Name | 2,5,6-tribromothieno[3,2-b]thiophene |
|---|
| SMILES | Brc1cc2sc(Br)c(Br)c2s1 |
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| InChI | InChI=1S/C6HBr3S2/c7-3-1-2-5(11-3)4(8)6(9)10-2/h1H |
|---|
| InChIKey | JFYOKEVNMWXDNQ-UHFFFAOYSA-N |
|---|
| XLogP | 5.25 |
|---|
| TPSA | 0.00 Ų |
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| H-Bond Donors | |
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| H-Bond Acceptors | 2 |
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| Rotatable Bonds | |
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| Heavy Atoms | 11 |
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| Complexity | — |
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Lipinski Rule of Five
1 violation
| Rule | Value |
|---|
| MW ≤ 500 | 376.92 |
| LogP ≤ 5 | 5.25 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2,5,6-tribromothieno[3,2-b]thiophene?
The IUPAC name of 2,5,6-tribromothieno[3,2-b]thiophene (CID 1211733) is 2,5,6-tribromothieno[3,2-b]thiophene.
What is the SMILES notation for 2,5,6-tribromothieno[3,2-b]thiophene?
The canonical SMILES for 2,5,6-tribromothieno[3,2-b]thiophene is Brc1cc2sc(Br)c(Br)c2s1.
What is the InChIKey of 2,5,6-tribromothieno[3,2-b]thiophene?
The InChIKey is JFYOKEVNMWXDNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6HBr3S2/c7-3-1-2-5(11-3)4(8)6(9)10-2/h1H.
What are the key properties of 2,5,6-tribromothieno[3,2-b]thiophene?
2,5,6-tribromothieno[3,2-b]thiophene has a molecular weight of 376.92 g/mol, XLogP of 5.25, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5,6-tribromothieno[3,2-b]thiophene is sourced from PubChem (CID 1211733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).