2D Chemical StructureDatabase ID 99770445
No renderable structure data available
SMILES
C1=CC(=C(C(=C1)C(F)(F)F)[N+](=O)[O-])C(=O)CC#NStructure data verified · Database ID 99770445
Chemical Intermediate
3-[2-nitro-3-(trifluoromethyl)phenyl]-3-oxopropanenitrile
CAS 1980039-04-0Product ID 312624
| Intermediates | 3-[2-nitro-3-(trifluoromethyl)phenyl]-3-oxopropanenitrile |
|---|---|
| IUPAC Name | — |
| CAS Number | 1980039-04-0 |
| Database ID | 99770445 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
3-[2-nitro-3-(trifluoromethyl)phenyl]-3-oxopropanenitrile
3-[2-nitro-3-(trifluoromethyl)phenyl]-3-oxopropanenitrile (CAS 1980039-04-0) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number1980039-04-0
Database ID99770445
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 99770445
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(=C1)C(F)(F)F)[N+](=O)[O-])C(=O)CC#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 1980039-04-03-[2-nitro-3-(trifluoromethyl)phenyl]-3-oxopropanenitrile
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