2D Chemical StructureDatabase ID 91800236
No renderable structure data available
SMILES
CC1=CC=C(C=C1)C(=O)C2=CC(=C(C(=C2)OS(=O)(=O)O)O)NStructure data verified · Database ID 91800236
Chemical Intermediate
Tolcapone 5-amino-3-O-sulfate
CAS 254902-29-9Product ID 753276
| Intermediates | Tolcapone 5-amino-3-O-sulfate |
|---|---|
| IUPAC Name | — |
| CAS Number | 254902-29-9 |
| Database ID | 91800236 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
Tolcapone 5-amino-3-O-sulfate
Tolcapone 5-amino-3-O-sulfate (CAS 254902-29-9) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number254902-29-9
Database ID91800236
Molecular Formula—
Updated2026-10-16
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 91800236
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- CC1=CC=C(C=C1)C(=O)C2=CC(=C(C(=C2)OS(=O)(=O)O)O)N
- 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 254902-29-9Tolcapone 5-amino-3-O-sulfate
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