Cas no 2646-51-7 (Benzeneacetic acid,4-hydroxy-3-iodo-5-nitro-)

Benzeneacetic acid,4-hydroxy-3-iodo-5-nitro- structure
2646-51-7 structure
Product Name:Benzeneacetic acid,4-hydroxy-3-iodo-5-nitro-
CAS No:2646-51-7
MF:C8H6INO5
MW:323.041414737701
CID:258622
PubChem ID:17553
Update Time:2025-10-29

Benzeneacetic acid,4-hydroxy-3-iodo-5-nitro- Chemical and Physical Properties

Names and Identifiers

    • Benzeneacetic acid,4-hydroxy-3-iodo-5-nitro-
    • 2-(4-hydroxy-3-iodo-5-nitrophenyl)acetic acid
    • 4-Hydroxy-3-iodo-5-nitrophenylacetic acid
    • Benzeneacetic acid,4-hydroxy-3-iodo-5-nitro
    • Nip-hapten
    • NITROHYDROXYIODOPHENYLACETATE
    • 4-hydroxy-3-iodo-5-nitro-benzeneacetic acid
    • CHEBI:53798
    • FT-0751615
    • NIP-OH
    • Q27124217
    • J-016443
    • 4-HYDROXY-3-IODO-5-NITRO-PHENYLACETICACID
    • 4-HYDROXY-3-IODO-5-NITRO-PHENYLACETIC ACID
    • SCHEMBL378767
    • Nitrohydroxyiodophenylacetic acid
    • AKOS024374943
    • (4-hydroxy-5-iodo-3-nitrophenyl)acetic acid
    • 2646-51-7
    • KPWFDZXSCIFGNO-UHFFFAOYSA-N
    • 4-hydroxy-3-iodo-5-nitrobenzeneacetic acid
    • Benzeneacetic acid, 4-hydroxy-3-iodo-5-nitro-
    • (4-hydroxy-3-iodo-5-nitrophenyl)acetic acid
    • DTXSID70181057
    • Inchi： 1S/C8H6INO5/c9-5-1-4(3-7(11)12)2-6(8(5)13)10(14)15/h1-2,13H,3H2,(H,11,12)
    • InChI Key： KPWFDZXSCIFGNO-UHFFFAOYSA-N
    • SMILES： IC1C(=C(C=C(C=1)CC(=O)O)[N+](=O)[O-])O

Computed Properties

  • Exact Mass: 322.92900
  • Monoisotopic Mass: 322.929
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 2
  • Complexity: 266
  • 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
  • Topological Polar Surface Area: 103A^2
  • XLogP3: 2.1

Experimental Properties

  • Density: 2.164
  • Boiling Point: 391.4°Cat760mmHg
  • Flash Point: 190.5°C
  • Refractive Index: 1.716
  • PSA: 103.35000
  • LogP: 2.05530

Benzeneacetic acid,4-hydroxy-3-iodo-5-nitro- Security Information

  • WGK Germany：3
  • Hazard Category Code： 36
  • Safety Instruction： S26
  • Hazardous Material Identification： Xi
  • Risk Phrases：R36
  • Storage Condition：?20°C

Benzeneacetic acid,4-hydroxy-3-iodo-5-nitro- Customs Data

  • HS CODE：2918290000
  • Customs Data：

    China Customs Code:

    2918290000

    Overview:

    2918290000 Other carboxylic acids and anhydrides containing phenolic groups but not other oxy groups\Acyl halide\Peroxides and peroxyacids and their derivatives.Regulatory conditions:AB(Customs clearance form for Inbound Goods,Customs clearance form for outbound goods).VAT:17.0%.Tax refund rate:9.0%.MFN tariff:6.5%.general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Regulatory conditions:

    A.Customs clearance form for Inbound Goods
    B.Customs clearance form for outbound goods

    Inspection and quarantine category:

    R.Sanitary supervision and inspection of imported food
    S.Sanitary supervision and inspection of exported food

    Summary:

    HS: 2918290000 other carboxylic acids with phenol function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) VAT:17.0% MFN tariff:6.5% General tariff:30.0%

Benzeneacetic acid,4-hydroxy-3-iodo-5-nitro- Pricemore >>

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Benzeneacetic acid,4-hydroxy-3-iodo-5-nitro- Related Literature

Additional information on Benzeneacetic acid,4-hydroxy-3-iodo-5-nitro-

Benzeneacetic acid,4-hydroxy-3-iodo-5-nitro- (CAS No. 2646-51-7): A Comprehensive Overview

Benzeneacetic acid,4-hydroxy-3-iodo-5-nitro- (CAS No. 2646-51-7) is a specialized organic compound that has garnered attention in various scientific and industrial applications. This compound, characterized by its unique molecular structure, plays a significant role in chemical synthesis and research. In this article, we delve into its properties, applications, and the latest market trends, while addressing common queries related to its use and significance.

The molecular formula of Benzeneacetic acid,4-hydroxy-3-iodo-5-nitro- reflects its complex structure, featuring a benzene ring substituted with acetic acid, hydroxyl, iodo, and nitro groups. This arrangement imparts distinct chemical properties, making it a valuable intermediate in organic synthesis. Researchers often explore its reactivity and stability under different conditions, which is crucial for designing efficient synthetic pathways.

One of the key applications of Benzeneacetic acid,4-hydroxy-3-iodo-5-nitro- is in the pharmaceutical industry, where it serves as a building block for active pharmaceutical ingredients (APIs). Its derivatives are investigated for potential therapeutic effects, aligning with the growing demand for novel drug candidates. Additionally, this compound finds use in agrochemical research, contributing to the development of advanced crop protection agents.

Recent trends in green chemistry have spurred interest in optimizing the synthesis of Benzeneacetic acid,4-hydroxy-3-iodo-5-nitro- to minimize environmental impact. Scientists are exploring catalytic methods and renewable resources to enhance the sustainability of its production. This aligns with global efforts to reduce the carbon footprint of chemical manufacturing processes.

From a market perspective, the demand for Benzeneacetic acid,4-hydroxy-3-iodo-5-nitro- is influenced by advancements in pharmaceuticals and agrochemicals. The compound's versatility and specificity make it a sought-after reagent in research laboratories and industrial settings. Analysts predict steady growth in its market value, driven by innovation in synthetic methodologies and expanding applications.

Safety and handling of Benzeneacetic acid,4-hydroxy-3-iodo-5-nitro- are critical considerations for users. Proper storage conditions, such as controlled temperature and humidity, are essential to maintain its stability. Researchers and manufacturers adhere to stringent protocols to ensure safe usage, emphasizing the importance of material safety data sheets (MSDS) and regulatory compliance.

In conclusion, Benzeneacetic acid,4-hydroxy-3-iodo-5-nitro- (CAS No. 2646-51-7) is a compound of significant scientific and industrial relevance. Its multifaceted applications, coupled with ongoing research into sustainable production methods, highlight its potential to address contemporary challenges in chemistry and related fields. As the scientific community continues to explore its capabilities, this compound remains a focal point of innovation and discovery.

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