2D Chemical StructureDatabase ID 23379143
No renderable structure data available
SMILES
COC(=O)C1=CC(=C(C=C1)C#N)BrStructure data verified · Database ID 23379143
Chemical Intermediate
methyl 3-bromo-4-cyanobenzoate
CAS 942598-44-9Product ID 588794
| Intermediates | methyl 3-bromo-4-cyanobenzoate |
|---|---|
| IUPAC Name | — |
| CAS Number | 942598-44-9 |
| Database ID | 23379143 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
methyl 3-bromo-4-cyanobenzoate
methyl 3-bromo-4-cyanobenzoate (CAS 942598-44-9) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number942598-44-9
Database ID23379143
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 23379143
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(=C(C=C1)C#N)Br
- 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 942598-44-9methyl 3-bromo-4-cyanobenzoate
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