2-(4-Methoxyphenyl)-3-oxobutanenitrile structure

2-(4-Methoxyphenyl)-3-oxobutanenitrile

2-(4-methoxyphenyl)-3-oxobutanenitrile

Also Known As: 2-(4-methoxyphenyl)-3-oxobutanenitrile|a-Acetyl-4-methoxybenzeneacetonitrile|2-(4-methoxyphenyl)-3-oxo-butanenitrile|EINECS 264-550-5|(1)-Acetyl(4-methoxyphenyl)acetonitrile|9785AB|2-(4-Methoxyphenyl)-3-oxobutanenitril|2-(4-methoxyphenyl)-3-oxobutyronitrile|Benzeneacetonitrile, alpha-acetyl-4-methoxy-|NCGC00319516-01|(+-)-acetyl(4-methoxyphenyl)acetonitrile|J2.882.877B|AB01316478-02|1H-1,2,3-Triazole-4-carbonyl chloride,1,5-diphenyl

CAS: 5472-64-0
Molecular Formula C11H11NO2
Molecular Weight 189.07898 g/mol
LogP 1.5
Topological Polar Surface Area 50.1 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 3
Rotatable Bonds 3
Exact Mass 189.07898
Monoisotopic Mass 189.07898
Heavy Atoms 14
Complexity 245.0

Chemical Identifiers

CAS Number 5472-64-0
SMILES CC(=O)C(C#N)C1=CC=C(C=C1)OC
InChIKey RCHYZFMBSVFQPT-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.

Heterocyclic Building Blocks (1 patents) Pharmaceutical Intermediates (2 patents)

Product Overview

2-(4-Methoxyphenyl)-3-oxobutanenitrile (CAS 5472-64-0), with molecular formula C11H11NO2 and molecular weight 189.07898 g/mol. IUPAC: 2-(4-methoxyphenyl)-3-oxobutanenitrile.

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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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2-(4-Methoxyphenyl)-3-oxobutanenitrile is a custom synthesis product. We offer services from milligram to kilogram scale.

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