2D Chemical StructureDatabase ID 50930841
No renderable structure data available
SMILES
CC1(C2=C(C=CC(=C2)S(=O)(=O)[O-])[N+](=C1/C=C/C=C/3\C(C4=C(N3CCCCCC(=O)ON5C(=O)CCC5=O)C=CC(=C4)S(=O)(=O)[O-])(C)C)CCCCCC(=O)ON6C(=O)CCC6=O)C.[K+]Structure data verified · Database ID 50930841
Chemical Intermediate
methyl-3H-indol-1-ium-5-sulfonate
CAS 1311966-47-8Product ID 728852
| Intermediates | methyl-3H-indol-1-ium-5-sulfonate |
|---|---|
| IUPAC Name | — |
| CAS Number | 1311966-47-8 |
| Database ID | 50930841 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
methyl-3H-indol-1-ium-5-sulfonate
methyl-3H-indol-1-ium-5-sulfonate (CAS 1311966-47-8) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number1311966-47-8
Database ID50930841
Molecular Formula—
Updated2026-10-16
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 50930841
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- CC1(C2=C(C=CC(=C2)S(=O)(=O)[O-])[N+](=C1/C=C/C=C/3\C(C4=C(N3CCCCCC(=O)ON5C(=O)CCC5=O)C=CC(=C4)S(=O)(=O)[O-])(C)C)CCCCCC(=O)ON6C(=O)CCC6=O)C.[K+]
- 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 1311966-47-8methyl-3H-indol-1-ium-5-sulfonate
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