2D Chemical StructureDatabase ID 86673167
No renderable structure data available
SMILES
CC(=O)C(CC1=CC=CC=N1)C#NStructure data verified · Database ID 86673167
Chemical Intermediate
3-oxo-2-(pyridin-2-ylmethyl)butanenitrile
CAS 1404449-46-2Product ID 187578
| Intermediates | 3-oxo-2-(pyridin-2-ylmethyl)butanenitrile |
|---|---|
| IUPAC Name | — |
| CAS Number | 1404449-46-2 |
| Database ID | 86673167 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
3-oxo-2-(pyridin-2-ylmethyl)butanenitrile
3-oxo-2-(pyridin-2-ylmethyl)butanenitrile (CAS 1404449-46-2) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number1404449-46-2
Database ID86673167
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 86673167
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- CC(=O)C(CC1=CC=CC=N1)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 1404449-46-23-oxo-2-(pyridin-2-ylmethyl)butanenitrile
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