2D Chemical StructureDatabase ID 144305
No renderable structure data available
SMILES
COC(=O)C(CC1=CC=CC=C1)N=C=SStructure data verified · Database ID 144305
Chemical Intermediate
methyl 2-isothiocyanato-3-phenylpropanoate
CAS 68521-58-4Product ID 491498
| Intermediates | methyl 2-isothiocyanato-3-phenylpropanoate |
|---|---|
| IUPAC Name | — |
| CAS Number | 68521-58-4 |
| Database ID | 144305 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
methyl 2-isothiocyanato-3-phenylpropanoate
methyl 2-isothiocyanato-3-phenylpropanoate (CAS 68521-58-4) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number68521-58-4
Database ID144305
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 144305
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- COC(=O)C(CC1=CC=CC=C1)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 68521-58-4methyl 2-isothiocyanato-3-phenylpropanoate
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