2D Chemical StructureDatabase ID 142406
No renderable structure data available
SMILES
CC1=CC(=CC(=C1)N=C=S)CStructure data verified · Database ID 142406
Chemical Intermediate
1-isothiocyanato-3,5-dimethylbenzene
CAS 40046-30-8Product ID 691681
| Intermediates | 1-isothiocyanato-3,5-dimethylbenzene |
|---|---|
| IUPAC Name | — |
| CAS Number | 40046-30-8 |
| Database ID | 142406 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
1-isothiocyanato-3,5-dimethylbenzene
1-isothiocyanato-3,5-dimethylbenzene (CAS 40046-30-8) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number40046-30-8
Database ID142406
Molecular Formula—
Updated2025-04-09
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 142406
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)N=C=S)C
- 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 40046-30-81-isothiocyanato-3,5-dimethylbenzene
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