2D Chemical StructureDatabase ID 53857
No renderable structure data available
SMILES
CC1=NC(=C(N1CC2=CC=CC=C2)SCC#N)[N+](=O)[O-]Structure data verified · Database ID 53857
Chemical Intermediate
2-(3-benzyl-2-methyl-5-nitroimidazol-4-yl)sulfanylacetonitrile
CAS 77952-79-5Product ID 517094
| Intermediates | 2-(3-benzyl-2-methyl-5-nitroimidazol-4-yl)sulfanylacetonitrile |
|---|---|
| IUPAC Name | — |
| CAS Number | 77952-79-5 |
| Database ID | 53857 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
2-(3-benzyl-2-methyl-5-nitroimidazol-4-yl)sulfanylacetonitrile
2-(3-benzyl-2-methyl-5-nitroimidazol-4-yl)sulfanylacetonitrile (CAS 77952-79-5) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number77952-79-5
Database ID53857
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 53857
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- CC1=NC(=C(N1CC2=CC=CC=C2)SCC#N)[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 77952-79-52-(3-benzyl-2-methyl-5-nitroimidazol-4-yl)sulfanylacetonitrile
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