2-Ethyl-2-(pyridin-4-YL)butanenitrile

HCID 19982136

Notes Reactions

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Basic information

Standard SMILES: CCC(C#N)(CC)c1ccncc1
InChIKey: NRGKKOOKWOBHMP-UHFFFAOYSA-N
Molecular formula: C11H14N2
Average molar mass: 174.24 g/mol

Names & identifiers

Preferred name: 2-Ethyl-2-(pyridin-4-YL)butanenitrile
IUPAC: 2-ethyl-2-pyridin-4-ylbutanenitrile

Names & synonyms

2-ETHYL-2-(PYRIDIN-4-YL)BUTANENITRILE92788-11-9SCHEMBL9786745NRGKKOOKWOBHMP-UHFFFAOYSA-N2-ethyl-2-(4-pyridyl) butyronitrile2-ethyl-2-(4-pyridyl)-butyronitrileAKOS019089069EN300-1270036

Database identifiers

PubChem CID: 19982136

Properties

Computed structural properties

XLogP: 2.2
Topological polar surface area: 36.7 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 3
Heavy atoms: 13
Formal charge: 0
Complexity: 191

Related reactions

1 records

New reaction record

HRID 1460626As reactantuspto-grants-1991_12

Compound notes

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