2D Chemical StructureDatabase ID 4635987
No renderable structure data available
SMILES
CC1CCC2=C(C1)SC(=C2C(=O)OC)N=C=SStructure data verified · Database ID 4635987
Chemical Intermediate
methyl 2-isothiocyanato-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
CAS 588713-28-4Product ID 463450
| Intermediates | methyl 2-isothiocyanato-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
|---|---|
| IUPAC Name | — |
| CAS Number | 588713-28-4 |
| Database ID | 4635987 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
methyl 2-isothiocyanato-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
methyl 2-isothiocyanato-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate (CAS 588713-28-4) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number588713-28-4
Database ID4635987
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 4635987
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- CC1CCC2=C(C1)SC(=C2C(=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 588713-28-4methyl 2-isothiocyanato-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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