2D Chemical StructureDatabase ID 131072936
No renderable structure data available
SMILES
CC1=CC(=CC(=C1C#N)Br)C(=O)OStructure data verified · Database ID 131072936
Chemical Intermediate
3-bromo-4-cyano-5-methylbenzoic acid
CAS 1805188-94-6Product ID 276298
| Intermediates | 3-bromo-4-cyano-5-methylbenzoic acid |
|---|---|
| IUPAC Name | — |
| CAS Number | 1805188-94-6 |
| Database ID | 131072936 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
3-bromo-4-cyano-5-methylbenzoic acid
3-bromo-4-cyano-5-methylbenzoic acid (CAS 1805188-94-6) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number1805188-94-6
Database ID131072936
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 131072936
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- CC1=CC(=CC(=C1C#N)Br)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 1805188-94-63-bromo-4-cyano-5-methylbenzoic acid
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