2D Chemical StructureDatabase ID 85804212
No renderable structure data available
SMILES
CCC(C)(CC(=O)OCC)C#NStructure data verified · Database ID 85804212
Chemical Intermediate
ethyl 3-cyano-3-methylpentanoate
CAS 39121-94-3Product ID 410378
| Intermediates | ethyl 3-cyano-3-methylpentanoate |
|---|---|
| IUPAC Name | — |
| CAS Number | 39121-94-3 |
| Database ID | 85804212 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
ethyl 3-cyano-3-methylpentanoate
ethyl 3-cyano-3-methylpentanoate (CAS 39121-94-3) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number39121-94-3
Database ID85804212
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 85804212
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- CCC(C)(CC(=O)OCC)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 39121-94-3ethyl 3-cyano-3-methylpentanoate
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