CAS 21667-64-1

3-Nitro-β-oxobenzenepropanenitrile

Description:

3-Nitro-β-oxobenzenepropanenitrile, identified by its CAS number 21667-64-1, is an organic compound characterized by the presence of a nitro group and a nitrile functional group. This compound features a benzene ring substituted with a nitro group at the meta position, along with a propanenitrile chain that includes a β-keto group. The presence of these functional groups contributes to its reactivity and potential applications in organic synthesis and medicinal chemistry. Typically, compounds of this nature exhibit polar characteristics due to the electronegative nitro and cyano groups, which can influence their solubility in various solvents. Additionally, the compound may exhibit biological activity, making it of interest in pharmaceutical research. Its synthesis and handling require careful consideration of safety protocols due to the potential hazards associated with nitro compounds and nitriles. Overall, 3-Nitro-β-oxobenzenepropanenitrile is a versatile compound with significant implications in chemical research and development.

Formula: C₉H₆N₂O₃

InChI: InChI=1S/C9H6N2O3/c10-5-4-9(12)7-2-1-3-8(6-7)11(13)14/h1-3,6H,4H2

InChI key: InChIKey=OTZUXMACTFIJAZ-UHFFFAOYSA-N

SMILES: C(CC#N)(=O)C1=CC(N(=O)=O)=CC=C1

Synonyms:

• 2-(3-Nitrobenzoyl)acetonitrile
• 3-Nitro-β-oxobenzenepropanenitrile
• 3-Nitrobenzoylacetonitrile
• 3-Nitrophenacyl cyanide
• Acetonitrile,(m-nitrobenzoyl)-
• m-Nitrophenacyl cyanide
• Benzenepropanenitrile, 3-nitro-β-oxo-

3-(3-Nitrophenyl)-3-oxopropanenitrile

CAS: 21667-64-1

Formula: C₉H₆N₂O₃

Purity: 97%

Molecular weight: 190.1555

Ref: IN-DA00C3E9

3-Nitrobenzoylacetonitrile

CAS: 21667-64-1

3-Nitrobenzoylacetonitrile

Formula: C₉H₆N₂O₃

Purity: ≥95%

Color and Shape: light brown powder

Molecular weight: 190.16g/mol

Ref: 54-OR7010

3-Nitrobenzoylacetonitrile

Controlled Product

CAS: 21667-64-1

Applications 3-Nitrobenzoylacetonitrile (cas# 21667-64-1) is a useful research chemical.

Formula: C₉H₆N₂O₃

Color and Shape: Yellow To Dark Yellow

Molecular weight: 190.155

Ref: TR-N495663

3-(3-Nitrophenyl)-3-oxopropanenitrile

CAS: 21667-64-1

Formula: C₉H₆N₂O₃

Purity: 95.0%

Color and Shape: Solid

Molecular weight: 190.158

Ref: 10-F225910