4,4-Dimethyl-3-oxo-2-(3-pyridylmethylene)pentanenitrile
4,4-dimethyl-3-oxo-2-(pyridin-3-ylmethylidene)pentanenitrile
Also Known As: KS-00003QIY|2-(2,2-DIMETHYLPROPANOYL)-3-(3-PYRIDYL)PROP-2-ENENITRILE|4,4-dimethyl-3-oxo-2-(3-pyridylmethylene)pentanenitrile|4,4-dimethyl-3-oxo-2-(pyridin-3-ylmethylidene)pentanenitrile
CAS: 890879-40-0
| Molecular Formula | C13H14N2O |
|---|---|
| Molecular Weight | 214.11061 g/mol |
| LogP | 2.60378 |
| Topological Polar Surface Area | 53.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 214.11061 |
| Monoisotopic Mass | 214.11061 |
| Heavy Atoms | 16 |
| Complexity | 447.06122 |
Chemical Identifiers
| CAS Number | 890879-40-0 |
|---|---|
| SMILES | CC(C)(C)C(=O)C(=CC1=CN=CC=C1)C#N |
Product Overview
4,4-Dimethyl-3-oxo-2-(3-pyridylmethylene)pentanenitrile (CAS 890879-40-0), with molecular formula C13H14N2O and molecular weight 214.11061 g/mol. IUPAC: 4,4-dimethyl-3-oxo-2-(pyridin-3-ylmethylidene)pentanenitrile.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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4,4-Dimethyl-3-oxo-2-(3-pyridylmethylene)pentanenitrile is a custom synthesis product. We offer services from milligram to kilogram scale.
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