About boranylidyneborane
boranylidyneborane (PubChem CID 6328200) has the molecular formula B2
and a molecular weight of 21.62 g/mol. Its IUPAC name is boranylidyneborane.
Molecular Properties
| Compound Name | boranylidyneborane |
|---|
| PubChem CID | 6328200 |
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| Molecular Formula | B2 |
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| Molecular Weight | 21.62 g/mol |
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| Exact Mass | 22.02 |
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| IUPAC Name | boranylidyneborane |
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| SMILES | B#B |
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| InChI | InChI=1S/B2/c1-2 |
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| InChIKey | ZOCHARZZJNPSEU-UHFFFAOYSA-N |
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| XLogP | -0.76 |
|---|
| TPSA | 0.00 Ų |
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| H-Bond Donors | |
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| H-Bond Acceptors | |
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| Rotatable Bonds | |
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| Heavy Atoms | 2 |
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| Complexity | — |
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Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|
| MW ≤ 500 | 21.62 |
| LogP ≤ 5 | -0.76 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
|---|
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Frequently Asked Questions
What is the IUPAC name of boranylidyneborane?
The IUPAC name of boranylidyneborane (CID 6328200) is boranylidyneborane.
What is the SMILES notation for boranylidyneborane?
The canonical SMILES for boranylidyneborane is B#B.
What is the InChIKey of boranylidyneborane?
The InChIKey is ZOCHARZZJNPSEU-UHFFFAOYSA-N. The full InChI is InChI=1S/B2/c1-2.
What are the key properties of boranylidyneborane?
boranylidyneborane has a molecular weight of 21.62 g/mol, XLogP of -0.76, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for boranylidyneborane is sourced from PubChem (CID 6328200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).