2D Chemical StructureDatabase ID 50998803
No renderable structure data available
SMILES
C#CC1=CC=CC(=C1)CC#NStructure data verified · Database ID 50998803
Chemical Intermediate
2-(3-ethynylphenyl)acetonitrile
CAS 1000514-27-1Product ID 540
| Intermediates | 2-(3-ethynylphenyl)acetonitrile |
|---|---|
| IUPAC Name | — |
| CAS Number | 1000514-27-1 |
| Database ID | 50998803 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
2-(3-ethynylphenyl)acetonitrile
2-(3-ethynylphenyl)acetonitrile (CAS 1000514-27-1) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number1000514-27-1
Database ID50998803
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 50998803
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(=C1)CC#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 1000514-27-12-(3-ethynylphenyl)acetonitrile
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