2D Chemical StructureDatabase ID 12069395
No renderable structure data available
SMILES
CC(C)CC(CC(=O)O)C#NStructure data verified · Database ID 12069395
Chemical Intermediate
3-cyano-5-methylhexanoic acid
CAS 181289-16-7Product ID 280214
| Intermediates | 3-cyano-5-methylhexanoic acid |
|---|---|
| IUPAC Name | — |
| CAS Number | 181289-16-7 |
| Database ID | 12069395 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
3-cyano-5-methylhexanoic acid
3-cyano-5-methylhexanoic acid (CAS 181289-16-7) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number181289-16-7
Database ID12069395
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 12069395
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- CC(C)CC(CC(=O)O)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 181289-16-73-cyano-5-methylhexanoic acid
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