2D Chemical StructureDatabase ID 5570
No renderable structure data available
SMILES
C[N+]1=CC=CC(=C1)C(=O)[O-]Structure data verified · Database ID 5570
Chemical Intermediate
Trigonelline
CAS 535-83-1Product ID 733222
| Intermediates | Trigonelline |
|---|---|
| IUPAC Name | — |
| CAS Number | 535-83-1 |
| Database ID | 5570 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
Trigonelline
Trigonelline (CAS 535-83-1) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number535-83-1
Database ID5570
Molecular Formula—
Updated2026-10-16
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 5570
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- C[N+]1=CC=CC(=C1)C(=O)[O-]
- 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 535-83-1Trigonelline
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