2D Chemical StructureDatabase ID 144849
No renderable structure data available
SMILES
C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N=C=SStructure data verified · Database ID 144849
Chemical Intermediate
3-nitrobenzoyl isothiocyanate
CAS 78225-78-2Product ID 517591
| Intermediates | 3-nitrobenzoyl isothiocyanate |
|---|---|
| IUPAC Name | — |
| CAS Number | 78225-78-2 |
| Database ID | 144849 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
3-nitrobenzoyl isothiocyanate
3-nitrobenzoyl isothiocyanate (CAS 78225-78-2) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number78225-78-2
Database ID144849
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 144849
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N=C=S
- 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 78225-78-23-nitrobenzoyl isothiocyanate
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