2D Chemical StructureDatabase ID 12730473
No renderable structure data available
SMILES
CC(=O)C1=CC(=CN1)C#NStructure data verified · Database ID 12730473
Chemical Intermediate
5-acetyl-1H-pyrrole-3-carbonitrile
CAS 80242-22-4Product ID 521838
| Intermediates | 5-acetyl-1H-pyrrole-3-carbonitrile |
|---|---|
| IUPAC Name | — |
| CAS Number | 80242-22-4 |
| Database ID | 12730473 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
5-acetyl-1H-pyrrole-3-carbonitrile
5-acetyl-1H-pyrrole-3-carbonitrile (CAS 80242-22-4) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number80242-22-4
Database ID12730473
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 12730473
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- CC(=O)C1=CC(=CN1)C#N
- InChI
- —
Safety Notice
Safety & Notes
For professional research and industrial use only. Review the supplier safety data sheet before handling.
PubChem References
Public References
These sources are listed in the compound's public database record.
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CAS 80242-22-45-acetyl-1H-pyrrole-3-carbonitrile
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