2D Chemical StructureDatabase ID 220032
No renderable structure data available
SMILES
CC1=CC=C(C=C1)SCCC#NStructure data verified · Database ID 220032
Chemical Intermediate
3-(4-methylphenyl)sulfanylpropanenitrile
CAS 5331-06-6Product ID 446513
| Intermediates | 3-(4-methylphenyl)sulfanylpropanenitrile |
|---|---|
| IUPAC Name | — |
| CAS Number | 5331-06-6 |
| Database ID | 220032 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
3-(4-methylphenyl)sulfanylpropanenitrile
3-(4-methylphenyl)sulfanylpropanenitrile (CAS 5331-06-6) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number5331-06-6
Database ID220032
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 220032
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- CC1=CC=C(C=C1)SCCC#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 5331-06-63-(4-methylphenyl)sulfanylpropanenitrile
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