2D Chemical StructureDatabase ID 251502
No renderable structure data available
SMILES
C1=CC=C2C(=C1)C(OC2=O)C[N+](=O)[O-]Structure data verified · Database ID 251502
Chemical Intermediate
3-(nitromethyl)-3H-2-benzofuran-1-one
CAS 3598-68-3Product ID 399325
| Intermediates | 3-(nitromethyl)-3H-2-benzofuran-1-one |
|---|---|
| IUPAC Name | — |
| CAS Number | 3598-68-3 |
| Database ID | 251502 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
3-(nitromethyl)-3H-2-benzofuran-1-one
3-(nitromethyl)-3H-2-benzofuran-1-one (CAS 3598-68-3) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number3598-68-3
Database ID251502
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 251502
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- C1=CC=C2C(=C1)C(OC2=O)C[N+](=O)[O-]
- 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 3598-68-33-(nitromethyl)-3H-2-benzofuran-1-one
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