2D Chemical StructureDatabase ID 258440
No renderable structure data available
SMILES
CC(C)C1=CC=CC(=C1)C#NStructure data verified · Database ID 258440
Chemical Intermediate
3-propan-2-ylbenzonitrile
CAS 40751-59-5Product ID 415947
| Intermediates | 3-propan-2-ylbenzonitrile |
|---|---|
| IUPAC Name | — |
| CAS Number | 40751-59-5 |
| Database ID | 258440 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
3-propan-2-ylbenzonitrile
3-propan-2-ylbenzonitrile (CAS 40751-59-5) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number40751-59-5
Database ID258440
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 258440
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- CC(C)C1=CC=CC(=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 40751-59-53-propan-2-ylbenzonitrile
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