CAS 939-79-7

4-Methyl-3-nitrobenzonitrile

Description:

4-Methyl-3-nitrobenzonitrile, with the CAS number 939-79-7, is an organic compound characterized by its aromatic structure, which includes a benzene ring substituted with both a methyl group and a nitro group, along with a cyano group. This compound typically appears as a solid at room temperature and is known for its pale yellow to light brown color. It is relatively insoluble in water but soluble in organic solvents such as ethanol and acetone. The presence of the nitro group contributes to its potential reactivity, making it a useful intermediate in organic synthesis, particularly in the production of pharmaceuticals and agrochemicals. Additionally, the cyano group imparts certain electronic properties that can influence the compound's reactivity and interactions with other chemical species. Safety precautions should be observed when handling this compound, as nitro compounds can be hazardous and may pose environmental risks. Overall, 4-Methyl-3-nitrobenzonitrile is a valuable compound in synthetic organic chemistry.

Formula: C₈H₆N₂O₂

InChI: InChI=1S/C8H6N2O2/c1-6-2-3-7(5-9)4-8(6)10(11)12/h2-4H,1H3

InChI key: InChIKey=KOFBNBCOGKLUOM-UHFFFAOYSA-N

SMILES: N(=O)(=O)C1=CC(C#N)=CC=C1C

Synonyms:

• 3-Nitro-4-methylbenzonitrile
• 3-Nitro-4-tolunitrile
• 4-Cyano-2-nitrotoluene
• 4-Methyl-3-nitro-benzonitrile
• 4-Methyl-3-nitrobenzonitrile
• Benzonitrile, 4-methyl-3-nitro-
• p-Tolunitrile, 3-nitro-
• 3-Nitro-p-tolunitrile

4-Methyl-3-nitrobenzonitrile

CAS: 939-79-7

Formula: C₈H₆N₂O₂

Purity: >98.0%(GC)

Color and Shape: White to Light yellow to Green powder to crystal

Molecular weight: 162.15

Ref: 3B-M1946

4-Methyl-3-nitrobenzonitrile

CAS: 939-79-7

Formula: C₈H₆N₂O₂

Purity: 95%

Color and Shape: Solid

Molecular weight: 162.1454

Ref: IN-DA006A4P

4-Methyl-3-nitrobenzonitrile

CAS: 939-79-7

4-Methyl-3-nitrobenzonitrile

Formula: C₈H₆N₂O₂

Purity: ≥95%

Color and Shape: pale yellow powder

Molecular weight: 162.15g/mol

Ref: 54-OR4834

4-Methyl-3-nitrobenzonitrile

CAS: 939-79-7

4-Methyl-3-nitrobenzonitrile is a potent antibacterial agent that belongs to the group of nitro compounds. It has been shown to be effective against gram negative bacteria at low concentrations. 4-Methyl-3-nitrobenzonitrile inhibits bacterial growth by binding to the enzyme nitroreductase, which is responsible for the conversion of nitrite ions to nitric oxide. This leads to a decrease in the production of toxic oxygen radicals, which are responsible for cell damage and death. 4-Methyl-3-nitrobenzonitrile has also been shown to have a linker length dependent antimicrobial activity against P. aeruginosa, with longer linkers being more active than shorter linkers.

Formula: C₈H₆N₂O₂

Purity: Min. 95%

Color and Shape: Powder

Molecular weight: 162.15 g/mol

Ref: 3D-FM02115

3-Nitro-p-tolunitrile

CAS: 939-79-7

Formula: C₈H₆N₂O₂

Purity: 95%

Color and Shape: Solid

Molecular weight: 162.148

Ref: 10-F036419