2D Chemical StructureDatabase ID 59463769
No renderable structure data available
SMILES
CC1=CC(=CC(=C1C)[N+](=O)[O-])C#NStructure data verified · Database ID 59463769
Chemical Intermediate
3,4-dimethyl-5-nitrobenzonitrile
CAS 52911-61-2Product ID 445453
| Intermediates | 3,4-dimethyl-5-nitrobenzonitrile |
|---|---|
| IUPAC Name | — |
| CAS Number | 52911-61-2 |
| Database ID | 59463769 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
3,4-dimethyl-5-nitrobenzonitrile
3,4-dimethyl-5-nitrobenzonitrile (CAS 52911-61-2) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number52911-61-2
Database ID59463769
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 59463769
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- CC1=CC(=CC(=C1C)[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 52911-61-23,4-dimethyl-5-nitrobenzonitrile
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