2D Chemical StructureDatabase ID 58488371
No renderable structure data available
SMILES
CC1=C([N+](=CC=C1)[O-])C2=CC(=CC=C2)C(=O)OC(C)(C)CStructure data verified · Database ID 58488371
Chemical Intermediate
tert-butyl 3-(3-methyl-1-oxidopyridin-1-ium-2-yl)benzoate
CAS 1083057-13-9Product ID 34825
| Intermediates | tert-butyl 3-(3-methyl-1-oxidopyridin-1-ium-2-yl)benzoate |
|---|---|
| IUPAC Name | — |
| CAS Number | 1083057-13-9 |
| Database ID | 58488371 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
tert-butyl 3-(3-methyl-1-oxidopyridin-1-ium-2-yl)benzoate
tert-butyl 3-(3-methyl-1-oxidopyridin-1-ium-2-yl)benzoate (CAS 1083057-13-9) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number1083057-13-9
Database ID58488371
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 58488371
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- CC1=C([N+](=CC=C1)[O-])C2=CC(=CC=C2)C(=O)OC(C)(C)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 1083057-13-9tert-butyl 3-(3-methyl-1-oxidopyridin-1-ium-2-yl)benzoate
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