2D Chemical StructureDatabase ID 12601887
No renderable structure data available
SMILES
COC(=O)C1=C(C=C(C=C1)C(F)(F)F)C#NStructure data verified · Database ID 12601887
Chemical Intermediate
methyl 2-cyano-4-(trifluoromethyl)benzoate
CAS 61500-86-5Product ID 470692
| Intermediates | methyl 2-cyano-4-(trifluoromethyl)benzoate |
|---|---|
| IUPAC Name | — |
| CAS Number | 61500-86-5 |
| Database ID | 12601887 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
methyl 2-cyano-4-(trifluoromethyl)benzoate
methyl 2-cyano-4-(trifluoromethyl)benzoate (CAS 61500-86-5) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number61500-86-5
Database ID12601887
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 12601887
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=C(C=C1)C(F)(F)F)C#N
- 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 61500-86-5methyl 2-cyano-4-(trifluoromethyl)benzoate
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