2D Chemical StructureDatabase ID 10931906
No renderable structure data available
SMILES
O=C(C)CCC1C=CC=CC=1C#NStructure data verified · Database ID 10931906
Chemical Intermediate
2-(3-oxobutyl)benzonitrile
CAS 189119-40-2Product ID 738677
| Intermediates | 2-(3-oxobutyl)benzonitrile |
|---|---|
| IUPAC Name | — |
| CAS Number | 189119-40-2 |
| Database ID | 10931906 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
2-(3-oxobutyl)benzonitrile
2-(3-oxobutyl)benzonitrile (CAS 189119-40-2) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number189119-40-2
Database ID10931906
Molecular Formula—
Updated2026-10-16
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 10931906
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- O=C(C)CCC1C=CC=CC=1C#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 189119-40-22-(3-oxobutyl)benzonitrile
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