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CAS 55474-40-3

:

4-Chloro-α-(1-oxopropyl)benzeneacetonitrile

Description:
4-Chloro-α-(1-oxopropyl)benzeneacetonitrile, with the CAS number 55474-40-3, is an organic compound characterized by its aromatic structure and functional groups. It features a chloro substituent on a benzene ring, which enhances its reactivity and influences its physical properties. The presence of the α-(1-oxopropyl) group indicates that it contains a ketone functional group, contributing to its potential as a reactive intermediate in various chemical reactions. This compound is typically a solid at room temperature and may exhibit moderate solubility in organic solvents due to its hydrophobic aromatic ring. Its nitrile group (-C≡N) suggests potential applications in organic synthesis, particularly in the formation of other functionalized compounds. The compound's reactivity can be attributed to the electron-withdrawing nature of the chloro and nitrile groups, which can affect nucleophilic attack and other chemical transformations. Safety data should be consulted for handling, as compounds with similar structures may pose health risks. Overall, 4-Chloro-α-(1-oxopropyl)benzeneacetonitrile is of interest in synthetic organic chemistry and may have applications in pharmaceuticals or agrochemicals.
Formula:C11H10ClNO
InChI:InChI=1/C11H10ClNO/c1-2-11(14)10(7-13)8-3-5-9(12)6-4-8/h3-6,10H,2H2,1H3
InChI key:InChIKey=NKRGJBDEEGULAN-UHFFFAOYSA-N
SMILES:C(C(CC)=O)(C#N)C1=CC=C(Cl)C=C1
Synonyms:
  • 2-(4-Chlorophenyl)-3-Oxopentanenitrile
  • 4-Chloro-α-(1-oxopropyl)benzeneacetonitrile
  • Benzeneacetonitrile, 4-chloro-α-(1-oxopropyl)-
  • Valeronitrile, 2-(p-chlorophenyl)-3-oxo-
  • 2-(4-Chlorophenyl)-3-oxovaleronitrile
  • 4-CHLORO-A-ETHYLCARBONYL BENZENEACETONITYUILE
  • 4-CHLORO-ALPHA-ETHYLCARBONYL BENZENEACETONITRILE
  • 1-Cyano-1-(p-chlorophenyl)-2-butanone
  • α-(4-Chlorophenyl)-α-propionylacetonitrile
  • a-(4-Chlorophenyl)-a-propionylacetonitrile
  • See more synonyms
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Found 3 products.
  • Pyrimethamine EP Impurity A
    Standalix
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    Pyrimethamine EP Impurity A

    CAS:
    Formula:C11H10ClNO
    Molecular weight:207.66

    Ref: ST-EA-CP-P114001

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  • Pyrimethamine Impurity 2
    TLC
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    Pyrimethamine Impurity 2

    CAS:
    Formula:C11H10ClNO
    Molecular weight:207.66

    Ref: 4Z-P-154008

    5mg
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  • α-(4-Chlorophenyl)-α-propionylacetonitrile
    TRC
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    α-(4-Chlorophenyl)-α-propionylacetonitrile

    Controlled Product
    CAS:
    <p>Applications Pyrimethamine intermediate.<br>References Takayama, K., et al.: Antimicrob. Agents Chemother., 33, 1493 (1989), Robson, C., et al.: J. Med. Chem., 40, 3040 (1997), Horton, J., et al.: J. Mol. Biol., 353, 334 (2005), Horton, J., et al.: J. Mol. Biol., 353, 334 (2005), Janin, Y., et al.: Bioorg. Med. Chem., 15, 2479 (2007),<br></p>
    Formula:C11H10ClNO
    Color and Shape:White To Brown
    Molecular weight:207.66

    Ref: TR-C379600

    100mg
    215.00€