Cas no 869942-83-6 (2-Methyl-3-nitrobenzohydrazide)

2-Methyl-3-nitrobenzohydrazide is a specialized organic compound featuring a benzohydrazide core substituted with a methyl group at the 2-position and a nitro group at the 3-position. This structure imparts unique reactivity, making it valuable as an intermediate in synthetic organic chemistry, particularly in the preparation of heterocyclic compounds and pharmaceutical derivatives. The presence of both electron-donating (methyl) and electron-withdrawing (nitro) groups enhances its versatility in nucleophilic and electrophilic reactions. Its well-defined crystalline form ensures consistent purity, facilitating precise applications in research and industrial processes. The compound is typically handled under controlled conditions due to its sensitivity to moisture and light.
2-Methyl-3-nitrobenzohydrazide structure
869942-83-6 structure
Product Name:2-Methyl-3-nitrobenzohydrazide
CAS No:869942-83-6
MF:C8H9N3O3
MW:195.175361394882
MDL:MFCD03422927
CID:719095
PubChem ID:3500967
Update Time:2025-05-25

2-Methyl-3-nitrobenzohydrazide Chemical and Physical Properties

Names and Identifiers

    • 2-Methyl-3-nitrobenzohydrazide
    • 2-Methyl-3-nitrobenzenecarbohydrazide
    • 2-methyl-3-nitrobenzohydrazide(SALTDATA: FREE)
    • Benzoic acid,2-methyl-3-nitro-, hydrazide
    • MFCD03422927
    • J-509955
    • F8889-9214
    • 12Y-0829
    • FT-0754735
    • AKOS000159242
    • 869942-83-6
    • 2-Methyl-3-nitrobenzhydrazide
    • BORONIC ACID, B-[2-CHLORO-4-(TRIFLUOROMETHYL)PHENYL]-
    • DTXSID20393087
    • CS-0313124
    • EN300-719420
    • MDL: MFCD03422927
    • Inchi: 1S/C8H9N3O3/c1-5-6(8(12)10-9)3-2-4-7(5)11(13)14/h2-4H,9H2,1H3,(H,10,12)
    • InChI Key: QWMRBDIVNHJWAU-UHFFFAOYSA-N
    • SMILES: O=C(C1C=CC=C(C=1C)[N+](=O)[O-])NN

Computed Properties

  • Exact Mass: 195.06439116g/mol
  • Monoisotopic Mass: 195.06439116g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 239
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.6
  • Topological Polar Surface Area: 101?2

2-Methyl-3-nitrobenzohydrazide Pricemore >>

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abcr
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Additional information on 2-Methyl-3-nitrobenzohydrazide

2-Methyl-3-nitrobenzohydrazide: A Comprehensive Overview

2-Methyl-3-nitrobenzohydrazide (CAS No. 869942-83-6) is a chemical compound that has garnered significant attention in recent years due to its unique properties and potential applications in various fields. This compound, also referred to as N'-nitrobenzohydrazide derivative, belongs to the class of hydrazides, which are known for their versatility in organic synthesis and catalytic processes. The structure of 2-Methyl-3-nitrobenzohydrazide consists of a benzene ring substituted with a methyl group at position 2 and a nitro group at position 3, along with a hydrazide functional group (-NHNH?). This combination of substituents imparts distinct chemical reactivity and physical properties to the molecule.

Recent studies have highlighted the role of 2-Methyl-3-nitrobenzohydrazide in the synthesis of heterocyclic compounds, which are widely used in pharmaceuticals, agrochemicals, and materials science. For instance, researchers have demonstrated that this compound can serve as an efficient precursor for the construction of pyridine derivatives, which are valuable in drug discovery due to their ability to modulate various biological targets. The nitro group at position 3 plays a critical role in these reactions by acting as an electron-withdrawing substituent, facilitating nucleophilic attacks and enhancing the reactivity of the molecule.

In addition to its synthetic applications, 2-Methyl-3-nitrobenzohydrazide has been explored for its potential in catalysis. The hydrazide functional group is known to coordinate with metal ions, making this compound a promising candidate for metalloenzyme mimics or heterogeneous catalysts. Recent advancements in green chemistry have emphasized the importance of developing eco-friendly catalysts, and 2-Methyl-3-nitrobenzohydrazide has shown promise in this regard. For example, it has been used as a ligand in cobalt-based catalysts for the oxidation of alcohols to ketones under mild conditions.

The stability and solubility properties of 2-Methyl-3-nitrobenzohydrazide are also critical factors that influence its applications. Studies have shown that this compound exhibits good thermal stability up to 150°C, making it suitable for high-temperature reactions. Furthermore, its solubility in polar solvents such as DMF and DMSO facilitates its use in solution-phase synthesis protocols. These characteristics make it a versatile building block in organic chemistry.

From an environmental perspective, understanding the fate and transport of 2-Methyl-3-nitrobenzohydrazide is essential for assessing its potential impact on ecosystems. Research indicates that this compound undergoes rapid degradation under UV light or enzymatic action, reducing its persistence in aquatic environments. This property is particularly important for industries involved in chemical manufacturing, as it aligns with global efforts to minimize environmental pollution.

In conclusion, 2-Methyl-3-nitrobenzohydrazide (CAS No. 869942-83-6) is a multifaceted compound with diverse applications across various scientific disciplines. Its unique structure enables it to participate in a wide range of chemical transformations, from organic synthesis to catalysis. As research continues to uncover new insights into its properties and potential uses, this compound is poised to play an increasingly important role in advancing modern chemistry.

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