2D Chemical StructureDatabase ID 2778452
No renderable structure data available
SMILES
FC1C=C(C)C=C(CC#N)C=1Structure data verified · Database ID 2778452
Chemical Intermediate
Benzeneacetonitrile, 3-fluoro-5-methyl- (9CI)
CAS 518070-21-8Product ID 769642
| Intermediates | Benzeneacetonitrile, 3-fluoro-5-methyl- (9CI) |
|---|---|
| IUPAC Name | — |
| CAS Number | 518070-21-8 |
| Database ID | 2778452 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
Benzeneacetonitrile, 3-fluoro-5-methyl- (9CI)
Benzeneacetonitrile, 3-fluoro-5-methyl- (9CI) (CAS 518070-21-8) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number518070-21-8
Database ID2778452
Molecular Formula—
Updated2025-04-09
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 2778452
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- FC1C=C(C)C=C(CC#N)C=1
- 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 518070-21-8Benzeneacetonitrile, 3-fluoro-5-methyl- (9CI)
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