2D Chemical StructureDatabase ID 223582
No renderable structure data available
SMILES
C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)SStructure data verified · Database ID 223582
Chemical Intermediate
3-nitrobenzenecarbothioic S-acid
CAS 5416-00-2Product ID 449457
| Intermediates | 3-nitrobenzenecarbothioic S-acid |
|---|---|
| IUPAC Name | — |
| CAS Number | 5416-00-2 |
| Database ID | 223582 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
3-nitrobenzenecarbothioic S-acid
3-nitrobenzenecarbothioic S-acid (CAS 5416-00-2) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number5416-00-2
Database ID223582
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 223582
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)S
- 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 5416-00-23-nitrobenzenecarbothioic S-acid
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