2D Chemical StructureDatabase ID 90474901
No renderable structure data available
SMILES
CC1=CC(=C(N1C)C)C2=C(/C(=C/3C=C([N+](=C3C)C)C)/C2=O)[O-]Structure data verified · Database ID 90474901
Chemical Intermediate
(4Z)-3-oxo-4-(1,2,5-trimethylpyrrol-1-ium-3-ylidene)-2-(1,2,5-trimethylpyrrol-3-yl)cyclobuten-1-olate
CAS 68842-58-0Product ID 492229
| Intermediates | (4Z)-3-oxo-4-(1,2,5-trimethylpyrrol-1-ium-3-ylidene)-2-(1,2,5-trimethylpyrrol-3-yl)cyclobuten-1-olate |
|---|---|
| IUPAC Name | — |
| CAS Number | 68842-58-0 |
| Database ID | 90474901 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
(4Z)-3-oxo-4-(1,2,5-trimethylpyrrol-1-ium-3-ylidene)-2-(1,2,5-trimethylpyrrol-3-yl)cyclobuten-1-olate
(4Z)-3-oxo-4-(1,2,5-trimethylpyrrol-1-ium-3-ylidene)-2-(1,2,5-trimethylpyrrol-3-yl)cyclobuten-1-olate (CAS 68842-58-0) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number68842-58-0
Database ID90474901
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 90474901
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- CC1=CC(=C(N1C)C)C2=C(/C(=C/3C=C([N+](=C3C)C)C)/C2=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 68842-58-0(4Z)-3-oxo-4-(1,2,5-trimethylpyrrol-1-ium-3-ylidene)-2-(1,2,5-trimethylpyrrol-3-yl)cyclobuten-1-olate
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