2D Chemical StructureDatabase ID 138010
No renderable structure data available
SMILES
CC1=CC(=CC=C1)CN=C=SStructure data verified · Database ID 138010
Chemical Intermediate
1-(isothiocyanatomethyl)-3-methylbenzene
CAS 3696-66-0Product ID 402210
| Intermediates | 1-(isothiocyanatomethyl)-3-methylbenzene |
|---|---|
| IUPAC Name | — |
| CAS Number | 3696-66-0 |
| Database ID | 138010 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
1-(isothiocyanatomethyl)-3-methylbenzene
1-(isothiocyanatomethyl)-3-methylbenzene (CAS 3696-66-0) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number3696-66-0
Database ID138010
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 138010
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- CC1=CC(=CC=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 3696-66-01-(isothiocyanatomethyl)-3-methylbenzene
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