2D Chemical StructureDatabase ID 12008882
No renderable structure data available
SMILES
C1OC2=CC=CC(=C2O1)C#NStructure data verified · Database ID 12008882
Chemical Intermediate
1,3-benzodioxole-4-carbonitrile
CAS 161886-19-7Product ID 242561
| Intermediates | 1,3-benzodioxole-4-carbonitrile |
|---|---|
| IUPAC Name | — |
| CAS Number | 161886-19-7 |
| Database ID | 12008882 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
1,3-benzodioxole-4-carbonitrile
1,3-benzodioxole-4-carbonitrile (CAS 161886-19-7) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number161886-19-7
Database ID12008882
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 12008882
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- C1OC2=CC=CC(=C2O1)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 161886-19-71,3-benzodioxole-4-carbonitrile
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