2D Chemical StructureDatabase ID 19409
No renderable structure data available
SMILES
CC1=CC=C(C=C1)CN=C=SStructure data verified · Database ID 19409
Chemical Intermediate
1-(isothiocyanatomethyl)-4-methylbenzene
CAS 3694-46-0Product ID 402129
| Intermediates | 1-(isothiocyanatomethyl)-4-methylbenzene |
|---|---|
| IUPAC Name | — |
| CAS Number | 3694-46-0 |
| Database ID | 19409 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
1-(isothiocyanatomethyl)-4-methylbenzene
1-(isothiocyanatomethyl)-4-methylbenzene (CAS 3694-46-0) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number3694-46-0
Database ID19409
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 19409
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)CN=C=S
- 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 3694-46-01-(isothiocyanatomethyl)-4-methylbenzene
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