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24526-69-0

24526-69-0 Structure

24526-69-0 Structure
IdentificationMore
[Name]

3-CYANO-4-METHYLCOUMARIN
[CAS]

24526-69-0
[Synonyms]

3-CYANO-4-METHYLCOUMARIN
3-CYANO-4-METHYLCOUMARIN 97%
4-methyl-2-oxochromene-3-carbonitrile
4-METHYL-2-OXO-2H-CHROMENE-3-CARBONITRILE
2H-1-Benzopyran-3-carbonitrile, 4-methyl-2-oxo-
JRH-01501, 4-Methyl-2-oxo-2H-chromene-3-carbonitrile, 97%
[Molecular Formula]

C11H7NO2
[MDL Number]

MFCD00486386
[Molecular Weight]

185.18
[MOL File]

24526-69-0.mol
Chemical PropertiesBack Directory
[Melting point ]

192-195 °C (dec.) (lit.)
[Boiling point ]

352.2±21.0 °C(Predicted)
[density ]

1.29±0.1 g/cm3(Predicted)
[storage temp. ]

2-8°C
[CAS DataBase Reference]

24526-69-0(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
[WGK Germany ]

3
Hazard InformationBack Directory
[Uses]

4-Methyl-2-oxo-2H-chromene-3-carbonitrile is a useful reactant for various organic reaction and synthesis of organic compounds.
[Synthesis Reference(s)]

Journal of the American Chemical Society, 75, p. 1886, 1953 DOI: 10.1021/ja01104a032
[General Description]

3-Cyano-4-methylcoumarin is a 3-substituted 4-methylcoumarin derivative. Its structural properties, vibrational frequencies and electronic spectra has been studied by density functional theory (DFT). It has been reported to be formed during the Knoevenagel condensation of o-hydroxyacetophenone with ethyl cyanoacetate catalyzed by calcined Mg-Al hydrotalcite. Synthesis of 3-cyano-4-methylcoumarin, via condensation of o-hydroxyacetophenone with ethyl cyanoacetate in the presence of sodium ethylate, has been reported.
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

24526-69-0(sigmaaldrich)
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