2D Chemical StructureDatabase ID 17382530
No renderable structure data available
SMILES
COC(=O)C1=CC(=C(C=C1)C(=O)OC)N=C=SStructure data verified · Database ID 17382530
Chemical Intermediate
dimethyl 2-isothiocyanatobenzene-1,4-dicarboxylate
CAS 489438-56-4Product ID 434309
| Intermediates | dimethyl 2-isothiocyanatobenzene-1,4-dicarboxylate |
|---|---|
| IUPAC Name | — |
| CAS Number | 489438-56-4 |
| Database ID | 17382530 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
dimethyl 2-isothiocyanatobenzene-1,4-dicarboxylate
dimethyl 2-isothiocyanatobenzene-1,4-dicarboxylate (CAS 489438-56-4) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number489438-56-4
Database ID17382530
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 17382530
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- COC(=O)C1=CC(=C(C=C1)C(=O)OC)N=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 489438-56-4dimethyl 2-isothiocyanatobenzene-1,4-dicarboxylate
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