2D Chemical StructureDatabase ID 71060125
No renderable structure data available
SMILES
COC(=O)C1=C(C=CC(=C1)C#N)C(F)(F)FStructure data verified · Database ID 71060125
Chemical Intermediate
methyl 5-cyano-2-(trifluoromethyl)benzoate
CAS 1415089-89-2Product ID 681398
| Intermediates | methyl 5-cyano-2-(trifluoromethyl)benzoate |
|---|---|
| IUPAC Name | — |
| CAS Number | 1415089-89-2 |
| Database ID | 71060125 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
methyl 5-cyano-2-(trifluoromethyl)benzoate
methyl 5-cyano-2-(trifluoromethyl)benzoate (CAS 1415089-89-2) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number1415089-89-2
Database ID71060125
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 71060125
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- COC(=O)C1=C(C=CC(=C1)C#N)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 1415089-89-2methyl 5-cyano-2-(trifluoromethyl)benzoate
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