2-Methyl-3-oxobutanenitrile
2-methyl-3-oxobutanenitrile
Also Known As: 2-Methyl-3-oxobutanenitrile|3-CYANO-2-BUTANONE|3-cyanobutan-2-one|2-CYANO-3-BUTANONE|alpha-acetylpropionitrile|2-Methyl-3-oxobutyronitrile|2-Methyl-3-keto-butyronitrile|2-methyl-3-oxo-butyronitrile|Butanenitrile,2-methyl-3-oxo|2-Methyl-3-oxobutanenitrile #|Butanenitrile,2-methyl-3-oxo-|Butanenitrile, 2-methyl-3-oxo-|6171AB|2-methyl-3-oxidanylidene-butanenitrile|X-3548|858-627-8
| Molecular Formula | C5H7NO |
|---|---|
| Molecular Weight | 97.052765 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 40.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 97.052765 |
| Monoisotopic Mass | 97.052765 |
| Heavy Atoms | 7 |
| Complexity | 119.0 |
Chemical Identifiers
| CAS Number | 4468-47-7 |
|---|---|
| SMILES | CC(C#N)C(=O)C |
| InChIKey | AMQCWPDDXYOEER-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Methyl-3-oxobutanenitrile (CAS 4468-47-7), with molecular formula C5H7NO and molecular weight 97.052765 g/mol. IUPAC: 2-methyl-3-oxobutanenitrile.
2-Methyl-3-oxobutanenitrile is a custom synthesis product. We offer services from milligram to kilogram scale.
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