2D Chemical StructureDatabase ID 14004840
No renderable structure data available
SMILES
CC1=C(C=C(C=C1)C#N)BrStructure data verified · Database ID 14004840
Chemical Intermediate
3-bromo-4-methylbenzonitrile
CAS 42872-74-2Product ID 666071
| Intermediates | 3-bromo-4-methylbenzonitrile |
|---|---|
| IUPAC Name | — |
| CAS Number | 42872-74-2 |
| Database ID | 14004840 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
3-bromo-4-methylbenzonitrile
3-bromo-4-methylbenzonitrile (CAS 42872-74-2) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number42872-74-2
Database ID14004840
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 14004840
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- CC1=C(C=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 42872-74-23-bromo-4-methylbenzonitrile
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