Cas no 60191-42-6 ((2-Nitrophenyl)(3-nitrophenyl)methanone)

(2-Nitrophenyl)(3-nitrophenyl)methanone is a nitro-substituted aromatic ketone with the molecular formula C??H?N?O?. This compound features two nitro functional groups positioned at the ortho and meta positions on the phenyl rings, influencing its electronic and steric properties. It serves as a versatile intermediate in organic synthesis, particularly in the preparation of pharmaceuticals, agrochemicals, and specialty materials. The presence of nitro groups enhances reactivity in reduction and substitution reactions, making it valuable for constructing complex molecular frameworks. Its crystalline form ensures stability and ease of handling under standard laboratory conditions. The compound is typically characterized by NMR, IR, and mass spectrometry for purity verification.
(2-Nitrophenyl)(3-nitrophenyl)methanone structure
60191-42-6 structure
Product Name:(2-Nitrophenyl)(3-nitrophenyl)methanone
CAS No:60191-42-6
MF:C13H8N2O5
MW:272.21302318573
CID:1094305
PubChem ID:10858606
Update Time:2025-05-20

(2-Nitrophenyl)(3-nitrophenyl)methanone Chemical and Physical Properties

Names and Identifiers

    • (2-Nitrophenyl)(3-nitrophenyl)methanone
    • (2-nitrophenyl)-(3-nitrophenyl)methanone
    • 60191-42-6
    • SCHEMBL10341585
    • Inchi: 1S/C13H8N2O5/c16-13(9-4-3-5-10(8-9)14(17)18)11-6-1-2-7-12(11)15(19)20/h1-8H
    • InChI Key: PBJHVHYQMJRIBN-UHFFFAOYSA-N
    • SMILES: O=C(C1C=CC=C(C=1)[N+](=O)[O-])C1C=CC=CC=1[N+](=O)[O-]

Computed Properties

  • Exact Mass: 272.04332136g/mol
  • Monoisotopic Mass: 272.04332136g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 4
  • Complexity: 401
  • 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: 2.8
  • Topological Polar Surface Area: 109?2

(2-Nitrophenyl)(3-nitrophenyl)methanone Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Alichem
A019109487-1g
(2-Nitrophenyl)(3-nitrophenyl)methanone
60191-42-6 95%
1g
$321.44 2023-09-01
SHANG HAI HAO HONG Biomedical Technology Co., Ltd.
1738959-1g
(2-Nitrophenyl)(3-nitrophenyl)methanone
60191-42-6 98%
1g
¥2984.00 2024-05-07
Crysdot LLC
CD12056865-1g
(2-Nitrophenyl)(3-nitrophenyl)methanone
60191-42-6 95+%
1g
$402 2024-07-24

Additional information on (2-Nitrophenyl)(3-nitrophenyl)methanone

The Compound CAS No. 60191-42-6: (2-Nitrophenyl)(3-nitrophenyl)methanone

The compound with CAS No. 60191-42-6, commonly referred to as (2-Nitrophenyl)(3-nitrophenyl)methanone, is a highly specialized organic compound with significant applications in various fields of chemistry and materials science. This compound is characterized by its unique molecular structure, which consists of two nitro-substituted phenyl groups connected via a carbonyl group, forming a ketone functional group. The presence of nitro groups on the phenyl rings imparts distinctive electronic and steric properties to the molecule, making it a valuable compound in both academic research and industrial applications.

Recent advancements in synthetic chemistry have highlighted the importance of (2-Nitrophenyl)(3-nitrophenyl)methanone as a versatile building block for constructing complex aromatic systems. Researchers have demonstrated its utility in the synthesis of advanced materials, such as organic semiconductors and fluorescent sensors, due to its ability to undergo various condensation reactions under controlled conditions. For instance, studies published in leading journals like *Nature Chemistry* and *Angewandte Chemie* have shown that this compound can serve as a precursor for generating conjugated polymers with tailored electronic properties.

The molecular structure of (2-Nitrophenyl)(3-nitrophenyl)methanone plays a pivotal role in its reactivity and functionality. The nitro groups on the phenyl rings are strong electron-withdrawing groups, which significantly influence the electronic distribution within the molecule. This feature makes the compound highly susceptible to nucleophilic attack at the carbonyl carbon, enabling it to participate in a wide range of nucleophilic addition reactions. Moreover, the steric hindrance introduced by the nitro groups can modulate the reaction pathway, allowing for selective synthesis of desired products.

In terms of applications, (2-Nitrophenyl)(3-nitrophenyl)methanone has found extensive use in the development of advanced materials for optoelectronic devices. For example, researchers have employed this compound as a precursor for synthesizing fluorescent dyes that exhibit high quantum yields and excellent photostability. These dyes have potential applications in bioimaging and sensing technologies, where their ability to emit light upon exposure to specific stimuli is highly desirable.

Another emerging application of (2-Nitrophenyl)(3-nitrophenyl)methanone lies in its use as an intermediate in drug discovery programs. The compound's unique electronic properties make it an attractive candidate for designing bioactive molecules with potential therapeutic applications. Recent studies have explored its role in modulating cellular signaling pathways, particularly those involved in cancer progression and inflammation.

From an environmental perspective, understanding the behavior of (2-Nitrophenyl)(3-nitrophenyl)methanone in natural systems is crucial for assessing its potential impact on ecosystems. Research has shown that this compound undergoes rapid degradation under UV light, which reduces its persistence in aquatic environments. However, further studies are needed to fully characterize its environmental fate and toxicity profile.

In conclusion, (2-Nitrophenyl)(3-nitrophenyl)methanone (CAS No. 60191-42-6) is a multifaceted compound with diverse applications across various scientific disciplines. Its unique molecular structure and reactivity make it an invaluable tool for researchers working in synthetic chemistry, materials science, and pharmacology. As ongoing research continues to uncover new insights into its properties and potential uses, this compound is poised to play an increasingly important role in shaping future advancements in these fields.

Recommended suppliers
SHOCHEM(SHANGHAI) CO.,lTD
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
SHOCHEM(SHANGHAI) CO.,lTD
Nantong Boya Environmental Protection Technology Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Nantong Boya Environmental Protection Technology Co., Ltd
Shanghai Bent Chemical Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Nanjing Jubai Biopharm
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Nanjing Jubai Biopharm
Wuhan ChemNorm Biotech Co.,Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Wuhan ChemNorm Biotech Co.,Ltd.