2D Chemical StructureDatabase ID 11074143
No renderable structure data available
SMILES
CCC(=O)C(C#N)C1=CC=C(C=C1)CStructure data verified · Database ID 11074143
Chemical Intermediate
2-(4-methylphenyl)-3-oxopentanenitrile
CAS 77186-57-3Product ID 514926
| Intermediates | 2-(4-methylphenyl)-3-oxopentanenitrile |
|---|---|
| IUPAC Name | — |
| CAS Number | 77186-57-3 |
| Database ID | 11074143 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
2-(4-methylphenyl)-3-oxopentanenitrile
2-(4-methylphenyl)-3-oxopentanenitrile (CAS 77186-57-3) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number77186-57-3
Database ID11074143
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 11074143
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=C(C=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 77186-57-32-(4-methylphenyl)-3-oxopentanenitrile
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