2D Chemical StructureDatabase ID 12701835
No renderable structure data available
SMILES
COC1=C(C=C(C=C1)[N+](=O)[O-])CC#NStructure data verified · Database ID 12701835
Chemical Intermediate
(2-Methoxy-5-nitrophenyl)acetonitrile
CAS 99459-52-6Product ID 747423
| Intermediates | (2-Methoxy-5-nitrophenyl)acetonitrile |
|---|---|
| IUPAC Name | — |
| CAS Number | 99459-52-6 |
| Database ID | 12701835 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
(2-Methoxy-5-nitrophenyl)acetonitrile
(2-Methoxy-5-nitrophenyl)acetonitrile (CAS 99459-52-6) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number99459-52-6
Database ID12701835
Molecular Formula—
Updated2026-10-16
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 12701835
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- COC1=C(C=C(C=C1)[N+](=O)[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 99459-52-6(2-Methoxy-5-nitrophenyl)acetonitrile
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