2D Chemical StructureDatabase ID 12340167
No renderable structure data available
SMILES
CC(=O)CC(=O)C1=CC=C(C=C1)C#NStructure data verified · Database ID 12340167
Chemical Intermediate
4-(3-oxobutanoyl)benzonitrile
CAS 62585-03-9Product ID 474089
| Intermediates | 4-(3-oxobutanoyl)benzonitrile |
|---|---|
| IUPAC Name | — |
| CAS Number | 62585-03-9 |
| Database ID | 12340167 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
4-(3-oxobutanoyl)benzonitrile
4-(3-oxobutanoyl)benzonitrile (CAS 62585-03-9) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number62585-03-9
Database ID12340167
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 12340167
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- CC(=O)CC(=O)C1=CC=C(C=C1)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 62585-03-94-(3-oxobutanoyl)benzonitrile
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