2D Chemical StructureDatabase ID 132327543
No renderable structure data available
SMILES
CC1=C(C=CC(=C1)C#N)CCN.C(=O)(C(F)(F)F)OStructure data verified · Database ID 132327543
Chemical Intermediate
4-(2-aminoethyl)-3-methylbenzonitrile;2,2,2-trifluoroacetic acid
CAS 2126177-31-7Product ID 333336
| Intermediates | 4-(2-aminoethyl)-3-methylbenzonitrile;2,2,2-trifluoroacetic acid |
|---|---|
| IUPAC Name | — |
| CAS Number | 2126177-31-7 |
| Database ID | 132327543 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
4-(2-aminoethyl)-3-methylbenzonitrile;2,2,2-trifluoroacetic acid
4-(2-aminoethyl)-3-methylbenzonitrile;2,2,2-trifluoroacetic acid (CAS 2126177-31-7) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number2126177-31-7
Database ID132327543
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 132327543
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- CC1=C(C=CC(=C1)C#N)CCN.C(=O)(C(F)(F)F)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 2126177-31-74-(2-aminoethyl)-3-methylbenzonitrile;2,2,2-trifluoroacetic acid
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