2D Chemical StructureDatabase ID 18942157
No renderable structure data available
SMILES
COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(F)(F)FStructure data verified · Database ID 18942157
Chemical Intermediate
methyl 3-nitro-5-(trifluoromethyl)benzoate
CAS 22227-63-0Product ID 342008
| Intermediates | methyl 3-nitro-5-(trifluoromethyl)benzoate |
|---|---|
| IUPAC Name | — |
| CAS Number | 22227-63-0 |
| Database ID | 18942157 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
methyl 3-nitro-5-(trifluoromethyl)benzoate
methyl 3-nitro-5-(trifluoromethyl)benzoate (CAS 22227-63-0) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number22227-63-0
Database ID18942157
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 18942157
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(=CC(=C1)[N+](=O)[O-])C(F)(F)F
- 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 22227-63-0methyl 3-nitro-5-(trifluoromethyl)benzoate
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