2D Chemical StructureDatabase ID 13089843
No renderable structure data available
SMILES
COC(=O)C(=O)C1=CC=C(C=C1)C#NStructure data verified · Database ID 13089843
Chemical Intermediate
methyl 2-(4-cyanophenyl)-2-oxoacetate
CAS 52798-47-7Product ID 445118
| Intermediates | methyl 2-(4-cyanophenyl)-2-oxoacetate |
|---|---|
| IUPAC Name | — |
| CAS Number | 52798-47-7 |
| Database ID | 13089843 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
methyl 2-(4-cyanophenyl)-2-oxoacetate
methyl 2-(4-cyanophenyl)-2-oxoacetate (CAS 52798-47-7) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number52798-47-7
Database ID13089843
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 13089843
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- COC(=O)C(=O)C1=CC=C(C=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 52798-47-7methyl 2-(4-cyanophenyl)-2-oxoacetate
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