2D Chemical StructureDatabase ID 90344762
No renderable structure data available
SMILES
CCOC(=O)C1=CC=C(C=C1)C(C)(C)C#NStructure data verified · Database ID 90344762
Chemical Intermediate
ethyl 4-(2-cyanopropan-2-yl)benzoate
CAS 1309580-85-5Product ID 137633
| Intermediates | ethyl 4-(2-cyanopropan-2-yl)benzoate |
|---|---|
| IUPAC Name | — |
| CAS Number | 1309580-85-5 |
| Database ID | 90344762 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
ethyl 4-(2-cyanopropan-2-yl)benzoate
ethyl 4-(2-cyanopropan-2-yl)benzoate (CAS 1309580-85-5) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number1309580-85-5
Database ID90344762
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 90344762
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- CCOC(=O)C1=CC=C(C=C1)C(C)(C)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 1309580-85-5ethyl 4-(2-cyanopropan-2-yl)benzoate
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