2D Chemical StructureDatabase ID 658812
No renderable structure data available
SMILES
CCC1=C2CCCCC2=C(C(=O)N1)C#NStructure data verified · Database ID 658812
Chemical Intermediate
1-ethyl-3-oxo-5,6,7,8-tetrahydro-2H-isoquinoline-4-carbonitrile
CAS 53661-27-1Product ID 447651
| Intermediates | 1-ethyl-3-oxo-5,6,7,8-tetrahydro-2H-isoquinoline-4-carbonitrile |
|---|---|
| IUPAC Name | — |
| CAS Number | 53661-27-1 |
| Database ID | 658812 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
1-ethyl-3-oxo-5,6,7,8-tetrahydro-2H-isoquinoline-4-carbonitrile
1-ethyl-3-oxo-5,6,7,8-tetrahydro-2H-isoquinoline-4-carbonitrile (CAS 53661-27-1) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number53661-27-1
Database ID658812
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 658812
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- CCC1=C2CCCCC2=C(C(=O)N1)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 53661-27-11-ethyl-3-oxo-5,6,7,8-tetrahydro-2H-isoquinoline-4-carbonitrile
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