2D Chemical StructureDatabase ID 22351648
No renderable structure data available
SMILES
COC(=O)C1=CC(=C(C=C1)S)[N+](=O)[O-]Structure data verified · Database ID 22351648
Chemical Intermediate
methyl 3-nitro-4-sulfanylbenzoate
CAS 59515-34-3Product ID 465186
| Intermediates | methyl 3-nitro-4-sulfanylbenzoate |
|---|---|
| IUPAC Name | — |
| CAS Number | 59515-34-3 |
| Database ID | 22351648 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
methyl 3-nitro-4-sulfanylbenzoate
methyl 3-nitro-4-sulfanylbenzoate (CAS 59515-34-3) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number59515-34-3
Database ID22351648
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 22351648
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- COC(=O)C1=CC(=C(C=C1)S)[N+](=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 59515-34-3methyl 3-nitro-4-sulfanylbenzoate
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