2D Chemical StructureDatabase ID 57149538
No renderable structure data available
SMILES
CC(C)(C#N)C1=CC=CC(=C1)C(=O)OStructure data verified · Database ID 57149538
Chemical Intermediate
3-(2-cyanopropan-2-yl)benzoic acid
CAS 872091-00-4Product ID 671788
| Intermediates | 3-(2-cyanopropan-2-yl)benzoic acid |
|---|---|
| IUPAC Name | — |
| CAS Number | 872091-00-4 |
| Database ID | 57149538 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
3-(2-cyanopropan-2-yl)benzoic acid
3-(2-cyanopropan-2-yl)benzoic acid (CAS 872091-00-4) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number872091-00-4
Database ID57149538
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 57149538
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- CC(C)(C#N)C1=CC=CC(=C1)C(=O)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 872091-00-43-(2-cyanopropan-2-yl)benzoic acid
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