About (Z)-1-bromo-2-iodoethene
(Z)-1-bromo-2-iodoethene (PubChem CID 91999329) has the molecular formula C2H2BrI
and a molecular weight of 232.85 g/mol. Its IUPAC name is (Z)-1-bromo-2-iodoethene.
Molecular Properties
| Compound Name | (Z)-1-bromo-2-iodoethene |
|---|
| PubChem CID | 91999329 |
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| Molecular Formula | C2H2BrI |
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| Molecular Weight | 232.85 g/mol |
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| Exact Mass | 231.84 |
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| IUPAC Name | (Z)-1-bromo-2-iodoethene |
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| SMILES | Br/C=C\I |
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| InChI | InChI=1S/C2H2BrI/c3-1-2-4/h1-2H/b2-1- |
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| InChIKey | UTDMSJMYYBXEPR-UPHRSURJSA-N |
|---|
| XLogP | 2.29 |
|---|
| 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 | 4 |
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| Complexity | — |
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Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|
| MW ≤ 500 | 232.85 |
| LogP ≤ 5 | 2.29 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'iodine', 'substructure': 'N/A'} |
|---|
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Frequently Asked Questions
What is the IUPAC name of (Z)-1-bromo-2-iodoethene?
The IUPAC name of (Z)-1-bromo-2-iodoethene (CID 91999329) is (Z)-1-bromo-2-iodoethene.
What is the SMILES notation for (Z)-1-bromo-2-iodoethene?
The canonical SMILES for (Z)-1-bromo-2-iodoethene is Br/C=C\I.
What is the InChIKey of (Z)-1-bromo-2-iodoethene?
The InChIKey is UTDMSJMYYBXEPR-UPHRSURJSA-N. The full InChI is InChI=1S/C2H2BrI/c3-1-2-4/h1-2H/b2-1-.
What are the key properties of (Z)-1-bromo-2-iodoethene?
(Z)-1-bromo-2-iodoethene has a molecular weight of 232.85 g/mol, XLogP of 2.29, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-bromo-2-iodoethene is sourced from PubChem (CID 91999329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).