2D Chemical StructureDatabase ID 24723978
No renderable structure data available
SMILES
CC(C)(C)CC(=O)C1=CC=CC=C1C#NStructure data verified · Database ID 24723978
Chemical Intermediate
2-(3,3-dimethylbutanoyl)benzonitrile
CAS 898764-17-5Product ID 563210
| Intermediates | 2-(3,3-dimethylbutanoyl)benzonitrile |
|---|---|
| IUPAC Name | — |
| CAS Number | 898764-17-5 |
| Database ID | 24723978 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
2-(3,3-dimethylbutanoyl)benzonitrile
2-(3,3-dimethylbutanoyl)benzonitrile (CAS 898764-17-5) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number898764-17-5
Database ID24723978
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 24723978
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- CC(C)(C)CC(=O)C1=CC=CC=C1C#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 898764-17-52-(3,3-dimethylbutanoyl)benzonitrile
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