CAS 619-24-9

3-Nitrobenzonitrile

Description:

3-Nitrobenzonitrile, with the CAS number 619-24-9, is an aromatic compound characterized by the presence of both a nitro group and a nitrile group attached to a benzene ring. Its molecular formula is C7H4N2O2, indicating that it contains seven carbon atoms, four hydrogen atoms, two nitrogen atoms, and two oxygen atoms. The nitro group (-NO2) is a strong electron-withdrawing group, which influences the reactivity and properties of the compound. 3-Nitrobenzonitrile is typically a pale yellow solid at room temperature and is soluble in organic solvents such as ethanol and acetone, but less soluble in water. This compound is often used in organic synthesis and as an intermediate in the production of pharmaceuticals and agrochemicals. Its reactivity can be attributed to the presence of the nitrile group (-C≡N), which can participate in various chemical reactions, including nucleophilic additions and substitutions. Safety precautions should be taken when handling this compound, as it may pose health risks if inhaled or ingested.

Formula: C₇H₄N₂O₂

InChI: InChI=1S/C7H4N2O2/c8-5-6-2-1-3-7(4-6)9(10)11/h1-4H

InChI key: InChIKey=RUSAWEHOGCWOPG-UHFFFAOYSA-N

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

Synonyms:

• 1-Cyano-3-nitrobenzene
• 3-Cyano-1-nitrobenzene
• 3-Cyanonitrobenzene
• Benzonitrile, 3-nitro-
• Benzonitrile, m-nitro-
• M-Nitrobenzonitrile
• NSC 5382
• m-Cyanonitrobenzene
• m-Nitro Benzonitrile
• 3-Nitrobenzonitrile

3-Nitrobenzonitrile

CAS: 619-24-9

Formula: C₇H₄N₂O₂

Purity: >99.0%(GC)

Color and Shape: White to Orange to Green powder to crystal

Molecular weight: 148.12

Ref: 3B-N0170

3-Nitrobenzonitrile, 98%

CAS: 619-24-9

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Formula: C₇H₄N₂O₂

Purity: 98%

Color and Shape: White to cream to yellow, Crystals or powder or crystalline powder or lumps or needles

Molecular weight: 148.12

Ref: 02-A15821

Benzonitrile, 3-nitro-

CAS: 619-24-9

Formula: C₇H₄N₂O₂

Purity: 98%

Color and Shape: Solid

Molecular weight: 148.1189

Ref: IN-DA00IKFU

3-Nitrobenzonitrile

CAS: 619-24-9

Formula: C₇H₄N₂O₂

Purity: ≥ 98.0%

Color and Shape: Off-white to yellow crystalline powder

Molecular weight: 148.12

Ref: 7W-GK6828

3-Nitrobenzonitrile

CAS: 619-24-9

3-Nitrobenzonitrile

Purity: 99%

Color and Shape: Solid

Molecular weight: 148.12g/mol

Ref: 54-OR28671

3-Nitrobenzonitrile

CAS: 619-24-9

3-Nitrobenzonitrile is a chemical compound with molecular formula C6H5NO2. It is used as an intermediate in the synthesis of other organic compounds. 3-Nitrobenzonitrile can be synthesized by reacting 3-nitrotoluene with sodium hydroxide in methanol solution. The reaction products are analyzed using a mass spectrometer, and the structural analysis is performed by using a matrix-assisted laser desorption/ionization time-of-flight mass spectrometry (MALDI TOF MS) technique. This compound can also be obtained from the reaction of nitrous acid with benzaldehyde in presence of a base catalyst. The structure of this molecule was first determined by magnetic resonance spectroscopy (NMR). This synthetic compound can also be identified via ionization techniques such as electron impact (EI) or chemical analyses such as gas chromatography–mass spectrometry (GCMS).

Formula: C₇H₄N₂O₂

Purity: Min. 95%

Color and Shape: Powder

Molecular weight: 148.12 g/mol

Ref: 3D-FN16368

3-Nitrobenzonitrile

CAS: 619-24-9

Formula: C₇H₄N₂O₂

Purity: 96%

Color and Shape: Crystalline Powder

Molecular weight: 148.121

Ref: 10-F050418