2D Chemical StructureDatabase ID 40425225
No renderable structure data available
SMILES
C1=CC(=CC(=C1)NC2=CC=C(C=C2)Br)C#NStructure data verified · Database ID 40425225
Chemical Intermediate
3-(4-bromoanilino)benzonitrile
CAS 458550-45-3Product ID 427923
| Intermediates | 3-(4-bromoanilino)benzonitrile |
|---|---|
| IUPAC Name | — |
| CAS Number | 458550-45-3 |
| Database ID | 40425225 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
3-(4-bromoanilino)benzonitrile
3-(4-bromoanilino)benzonitrile (CAS 458550-45-3) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number458550-45-3
Database ID40425225
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 40425225
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- C1=CC(=CC(=C1)NC2=CC=C(C=C2)Br)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 458550-45-33-(4-bromoanilino)benzonitrile
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