2D Chemical StructureDatabase ID 62829952
No renderable structure data available
SMILES
CCC(=O)C(C#N)C1=CC=CC(=C1)CStructure data verified · Database ID 62829952
Chemical Intermediate
2-(3-methylphenyl)-3-oxopentanenitrile
CAS 105104-81-2Product ID 27150
| Intermediates | 2-(3-methylphenyl)-3-oxopentanenitrile |
|---|---|
| IUPAC Name | — |
| CAS Number | 105104-81-2 |
| Database ID | 62829952 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
2-(3-methylphenyl)-3-oxopentanenitrile
2-(3-methylphenyl)-3-oxopentanenitrile (CAS 105104-81-2) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number105104-81-2
Database ID62829952
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 62829952
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- CCC(=O)C(C#N)C1=CC=CC(=C1)C
- 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 105104-81-22-(3-methylphenyl)-3-oxopentanenitrile
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