3-CYANO-4-METHYLCOUMARIN

3-CYANO-4-METHYLCOUMARIN Struktur
24526-69-0
CAS-Nr.
24526-69-0
Englisch Name:
3-CYANO-4-METHYLCOUMARIN
Synonyma:
4-METHYL-2-OXO-2H-CHROMENE-3-CARBONITRILE;3-CYANO-4-METHYLCOUMARIN;3-CYANO-4-METHYLCOUMARIN 97%;4-methyl-2-oxochromene-3-carbonitrile;2H-1-Benzopyran-3-carbonitrile, 4-methyl-2-oxo-;JRH-01501, 4-Methyl-2-oxo-2H-chromene-3-carbonitrile, 97%
CBNumber:
CB7378083
Summenformel:
C11H7NO2
Molgewicht:
185.18
MOL-Datei:
24526-69-0.mol

3-CYANO-4-METHYLCOUMARIN Eigenschaften

Schmelzpunkt:
192-195 °C (dec.) (lit.)
Siedepunkt:
352.2±21.0 °C(Predicted)
Dichte
1.29±0.1 g/cm3(Predicted)
storage temp. 
2-8°C
Löslichkeit
DMSO (Slightly, Heated), Methanol (Slightly)
Aggregatzustand
Solid
Farbe
White to Off-White
InChI
1S/C11H7NO2/c1-7-8-4-2-3-5-10(8)14-11(13)9(7)6-12/h2-5H,1H3
InChIKey
FFBLBFMTKGSSPY-UHFFFAOYSA-N
SMILES
CC1=C(C#N)C(=O)Oc2ccccc12
CAS Datenbank
24526-69-0(CAS DataBase Reference)

Sicherheit

Kennzeichnung gefährlicher Xn
R-Sätze: 20/21/22
S-Sätze: 26-36
WGK Germany  3
HS Code  2932209090
Speicherklasse 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Dermal
Acute Tox. 4 Inhalation
Acute Tox. 4 Oral

3-CYANO-4-METHYLCOUMARIN Chemische Eigenschaften,Einsatz,Produktion Methoden

R-Sätze Betriebsanweisung:

R20/21/22:Gesundheitsschädlich beim Einatmen,Verschlucken und Berührung mit der Haut.

S-Sätze Betriebsanweisung:

S26:Bei Berührung mit den Augen sofort gründlich mit Wasser abspülen und Arzt konsultieren.
S36:DE: Bei der Arbeit geeignete Schutzkleidung tragen.

Verwenden

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

Allgemeine Beschreibung

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.

3-CYANO-4-METHYLCOUMARIN Upstream-Materialien And Downstream Produkte

Upstream-Materialien

Downstream Produkte


3-CYANO-4-METHYLCOUMARIN Anbieter Lieferant Produzent Hersteller Vertrieb Händler.

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  • 3-CYANO-4-METHYLCOUMARIN
  • 4-methyl-2-oxochromene-3-carbonitrile
  • 3-CYANO-4-METHYLCOUMARIN 97%
  • JRH-01501, 4-Methyl-2-oxo-2H-chromene-3-carbonitrile, 97%
  • 2H-1-Benzopyran-3-carbonitrile, 4-methyl-2-oxo-
  • 4-METHYL-2-OXO-2H-CHROMENE-3-CARBONITRILE
  • 24526-69-0
  • Heterocyclic Building Blocks
  • Coumarins
  • Building Blocks
  • Building Blocks
  • Heterocyclic Building Blocks
  • Coumarins
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