Cas no 27996-87-8 (2-Fluoro-5-nitrobenzaldehyde)

2-Fluoro-5-nitrobenzaldehyde is a fluorinated aromatic aldehyde with a nitro substituent, commonly employed as a versatile intermediate in organic synthesis. Its key advantages include its reactivity as an electrophile in nucleophilic aromatic substitution (SNAr) reactions, facilitated by the electron-withdrawing effects of both the fluorine and nitro groups. This compound is particularly useful in the synthesis of pharmaceuticals, agrochemicals, and specialty materials, where its functional groups enable precise modifications to molecular frameworks. The fluorine atom enhances metabolic stability in bioactive molecules, while the nitro group serves as a precursor for further derivatization, such as reduction to amines. Its well-defined reactivity and stability make it a valuable reagent in research and industrial applications.
2-Fluoro-5-nitrobenzaldehyde structure
2-Fluoro-5-nitrobenzaldehyde structure
Product Name:2-Fluoro-5-nitrobenzaldehyde
CAS No:27996-87-8
MF:C7H4FNO3
MW:169.109965324402
MDL:MFCD00042298
CID:53251
PubChem ID:24868563
Update Time:2025-06-08

2-Fluoro-5-nitrobenzaldehyde Chemical and Physical Properties

Names and Identifiers

    • 2-Fluoro-5-nitrobenzaldehyde
    • 2-Fluoro-5-nitro-benzaldehyde
    • 4-Fluoro-3-formylnitrobenzene
    • 5-nitro-2-fluorobenzaldehyde
    • Fluoro Nitrobenzaldehyde
    • Benzaldehyde, 2-fluoro-5-nitro-
    • PubChem1459
    • ASISCHEM D51510
    • 2-fluoro-5 nitrobenzaldehyde
    • KSC494K5R
    • PARAGOS 530043
    • 2-fluoranyl-5-nitro-benzaldehyde
    • VVXFDFQEIRGULC-UHFFFAOYSA-N
    • WT1579
    • SBB064390
    • AKOS000104244
    • 2-Fluoro-5-nitrobenzaldehyde, 97%
    • SY009227
    • DS-12545
    • A5360
    • Z1203159370
    • AC-1180
    • CS-W001207
    • FT-0612367
    • A819275
    • BP-13367
    • 27996-87-8
    • F0618
    • EN300-78177
    • AM20040076
    • DTXSID20370494
    • J-509463
    • MFCD00042298
    • SCHEMBL349039
    • DTXCID40321529
    • DB-023867
    • MDL: MFCD00042298
    • Inchi: 1S/C7H4FNO3/c8-7-2-1-6(9(11)12)3-5(7)4-10/h1-4H
    • InChI Key: VVXFDFQEIRGULC-UHFFFAOYSA-N
    • SMILES: FC1C=CC(=CC=1C=O)[N+](=O)[O-]
    • BRN: 1950329

Computed Properties

  • Exact Mass: 169.01800
  • Monoisotopic Mass: 169.018
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 192
  • 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
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 1.3
  • Topological Polar Surface Area: 62.9

Experimental Properties

  • Color/Form: Not determined
  • Density: 1.443
  • Melting Point: 57.0 to 61.0 deg-C
  • Boiling Point: 269.7°C at 760 mmHg
  • Flash Point: 116.9℃
  • Refractive Index: 1.59
  • Water Partition Coefficient: It is insoluble in water.
  • PSA: 62.89000
  • LogP: 2.06960
  • Solubility: water
  • Sensitiveness: Air Sensitive

2-Fluoro-5-nitrobenzaldehyde Security Information

  • Symbol: GHS07
  • Prompt:warning
  • Signal Word:Warning
  • Hazard Statement: H315,H319,H335
  • Warning Statement: P261,P305+P351+P338
  • Hazardous Material transportation number:PG3
  • WGK Germany:3
  • Hazard Category Code: 36/37/38
  • Safety Instruction: S26-S36
  • Hazardous Material Identification: Xi
  • Safety Term:S26;S36
  • HazardClass:IRRITANT
  • Storage Condition:Inert atmosphere,2-8°C
  • Risk Phrases:R36/37/38

2-Fluoro-5-nitrobenzaldehyde Customs Data

  • HS CODE:2913000090
  • Customs Data:

    China Customs Code:

    2913000090

    Overview:

    2913000090 Item2912Other derivatives of the listed products [refer to halogenation,sulfonation,Nitrosative or nitrosative derivatives]. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:5.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    HS: 2913000090 halogenated, sulphonated, nitrated or nitrosated derivatives of products of heading 2912 Educational tariff:17.0% Tax rebate rate:9.0% Regulatory conditions:none Most favored nation tariff:5.5% General tariff:30.0%

2-Fluoro-5-nitrobenzaldehyde Pricemore >>

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2-Fluoro-5-nitrobenzaldehyde Suppliers

Tiancheng Chemical (Jiangsu) Co., Ltd
Gold Member
Audited Supplier Audited Supplier
(CAS:27996-87-8)2-氟-5-硝基苯甲醛
Order Number:LE1931995
Stock Status:in Stock
Quantity:25KG,200KG,1000KG
Purity:99%
Pricing Information Last Updated:Friday, 20 June 2025 12:37
Price ($):discuss personally

2-Fluoro-5-nitrobenzaldehyde Related Literature

Additional information on 2-Fluoro-5-nitrobenzaldehyde

Recent Advances in the Application of 2-Fluoro-5-nitrobenzaldehyde (CAS: 27996-87-8) in Chemical Biology and Pharmaceutical Research

2-Fluoro-5-nitrobenzaldehyde (CAS: 27996-87-8) is a key intermediate in the synthesis of various bioactive molecules, particularly in the development of pharmaceuticals and agrochemicals. Recent studies have highlighted its versatility as a building block in organic synthesis, enabling the construction of complex molecular architectures with potential therapeutic applications. This research brief aims to summarize the latest advancements in the utilization of 2-Fluoro-5-nitrobenzaldehyde, focusing on its role in drug discovery, chemical biology, and material science.

One of the most notable applications of 2-Fluoro-5-nitrobenzaldehyde is in the synthesis of novel kinase inhibitors. A 2023 study published in the Journal of Medicinal Chemistry demonstrated its use in the development of selective FGFR (Fibroblast Growth Factor Receptor) inhibitors, which show promise in treating cancers with FGFR aberrations. The nitro and aldehyde functional groups in 2-Fluoro-5-nitrobenzaldehyde allow for facile derivatization, enabling the rapid generation of diverse compound libraries for high-throughput screening.

In chemical biology, researchers have exploited the reactivity of 2-Fluoro-5-nitrobenzaldehyde to create fluorescent probes for detecting reactive oxygen species (ROS) in cellular systems. A recent Nature Chemical Biology paper described a novel probe design where the aldehyde group forms a Schiff base with aminooxy-functionalized fluorophores, resulting in highly sensitive and selective ROS sensors. This application underscores the compound's utility in developing tools for studying oxidative stress-related diseases.

The pharmaceutical industry has also benefited from innovations in the scalable synthesis of 2-Fluoro-5-nitrobenzaldehyde. A 2024 Green Chemistry publication reported an improved catalytic process for its production, featuring higher yields (up to 92%) and reduced environmental impact compared to traditional methods. This advancement addresses the growing demand for sustainable manufacturing of key intermediates in drug development.

Emerging research has explored the use of 2-Fluoro-5-nitrobenzaldehyde in materials science, particularly in the synthesis of photoactive polymers. Its electron-withdrawing nitro group and the reactive aldehyde functionality make it an ideal monomer for constructing conjugated polymers with tunable optoelectronic properties. These materials show potential applications in organic electronics and sensing devices.

In conclusion, 2-Fluoro-5-nitrobenzaldehyde continues to be a valuable scaffold in multiple research domains. Its chemical versatility, coupled with recent synthetic improvements, ensures its ongoing relevance in drug discovery and materials development. Future research directions may focus on expanding its applications in targeted drug delivery systems and as a precursor for novel heterocyclic compounds with enhanced bioactivity.

Recommended suppliers
Tiancheng Chemical (Jiangsu) Co., Ltd
(CAS:27996-87-8)2-氟-5-硝基苯甲醛
LE1931995
Purity:99%
Quantity:25KG,200KG,1000KG
Price ($):Inquiry
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