2D Chemical StructureDatabase ID 69902
No renderable structure data available
SMILES
C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])C#NStructure data verified · Database ID 69902
Chemical Intermediate
2-nitro-4-(trifluoromethyl)benzonitrile
CAS 778-94-9Product ID 670886
| Intermediates | 2-nitro-4-(trifluoromethyl)benzonitrile |
|---|---|
| IUPAC Name | — |
| CAS Number | 778-94-9 |
| Database ID | 69902 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
2-nitro-4-(trifluoromethyl)benzonitrile
2-nitro-4-(trifluoromethyl)benzonitrile (CAS 778-94-9) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number778-94-9
Database ID69902
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 69902
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])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 778-94-92-nitro-4-(trifluoromethyl)benzonitrile
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