2D Chemical StructureDatabase ID 83554
No renderable structure data available
SMILES
COC(=O)C1=CC=CC(=C1)C#NStructure data verified · Database ID 83554
Chemical Intermediate
methyl 3-cyanobenzoate
CAS 13531-48-1Product ID 659994
| Intermediates | methyl 3-cyanobenzoate |
|---|---|
| IUPAC Name | — |
| CAS Number | 13531-48-1 |
| Database ID | 83554 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
methyl 3-cyanobenzoate
methyl 3-cyanobenzoate (CAS 13531-48-1) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number13531-48-1
Database ID83554
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 83554
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- COC(=O)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 13531-48-1methyl 3-cyanobenzoate
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