2D Chemical StructureDatabase ID 12143713
No renderable structure data available
SMILES
C#CC1=CC=CC=C1N=C=OStructure data verified · Database ID 12143713
Chemical Intermediate
1-ethynyl-2-isocyanatobenzene
CAS 554459-16-4Product ID 453653
| Intermediates | 1-ethynyl-2-isocyanatobenzene |
|---|---|
| IUPAC Name | — |
| CAS Number | 554459-16-4 |
| Database ID | 12143713 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
1-ethynyl-2-isocyanatobenzene
1-ethynyl-2-isocyanatobenzene (CAS 554459-16-4) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number554459-16-4
Database ID12143713
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 12143713
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- C#CC1=CC=CC=C1N=C=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 554459-16-41-ethynyl-2-isocyanatobenzene
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