Cas no 29898-32-6 (2,4-Dichloro-1-iodobenzene)
2,4-Dichloro-1-iodobenzene Chemical and Physical Properties
Names and Identifiers
-
- 2,4-Dichloro-1-iodobenzene
- 1,3-DICHLORO-4-IODOBENZENE
- 2,4-DICHLOROIODOBENZENE
- Benzene, 2,4-dichloro-1-iodo-
- 1-Iodo-2,4-dichlorobenzene
- 2,4-Dichlorophenyl iodide
- 1,3-dichloro-6-iodobenzene
- 2,3:5,6-DI-O-ISOPROPYLIDENE-L-GULONOLACTONE
- 2,4-dichloro-1-iodo-benzene
- NSC 90657
- ZQKJCBDCOGLKCQ-UHFFFAOYSA-N
- NSC90657
- PubChem3692
- 2,4-Dichlor-jodbenzol
- 1,3-dichloro4-iodobenzene
- 1,3-dichloro 4-iodobenzene
- 3075AB
- AS-10192
- AKOS009159391
- NS00028802
- Z401400338
- J-640245
- FT-0610059
- DTXSID00184011
- EINECS 249-938-4
- UNII-QK5EJG6XB6
- MFCD00001035
- D1441
- J-800244
- F19982
- SY049002
- InChI=1/C6H3Cl2I/c7-4-1-2-6(9)5(8)3-4/h1-3
- SCHEMBL767463
- A820101
- 2,4-bis(chloranyl)-1-iodanyl-benzene
- 2,4-Dichloroiodobenzene, 98%
- NSC-90657
- QK5EJG6XB6
- 29898-32-6
- CS-0116211
- EN300-131629
-
- MDL: MFCD00001035
- Inchi: 1S/C6H3Cl2I/c7-4-1-2-6(9)5(8)3-4/h1-3H
- InChI Key: ZQKJCBDCOGLKCQ-UHFFFAOYSA-N
- SMILES: IC1C=CC(=CC=1Cl)Cl
- BRN: 2245130
Computed Properties
- Exact Mass: 271.86600
- Monoisotopic Mass: 271.866
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 9
- Rotatable Bond Count: 0
- Complexity: 97.1
- 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: 4.5
- Topological Polar Surface Area: 0
Experimental Properties
- Color/Form: Yellow liquid
- Density: 2.01?g/mL?at 25?°C(lit.)
- Melting Point: 97-100°C
- Boiling Point: 262-263?°C(lit.)
- Flash Point: Degrees Fahrenheit:235.4°F
Degrees Celsius:113°C - Refractive Index: n20/D 1.647(lit.)
- PSA: 0.00000
- LogP: 3.59800
- Solubility: Insoluble in water
- Sensitiveness: Light Sensitive
2,4-Dichloro-1-iodobenzene Security Information
-
Symbol:
- Prompt:warning
- Signal Word:Warning
- Hazard Statement: H315-H319
- Warning Statement: P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
- Hazardous Material transportation number:NONH for all modes of transport
- WGK Germany:3
- Hazard Category Code: 36/37/38
- Safety Instruction: S26; S37/39
-
Hazardous Material Identification:
- Safety Term:S26-S37/39-S24/25
- Risk Phrases:R36/37/38
- Storage Condition:Store at room temperature
2,4-Dichloro-1-iodobenzene Customs Data
- HS CODE:2903999090
- Customs Data:
China Customs Code:
2903999090Overview:
2903999090 Other aromatic halogenated 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:
2903999090 halogenated derivatives of aromatic hydrocarbons VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%
2,4-Dichloro-1-iodobenzene Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd. | D870232-100g |
2,4-Dichloro-1-iodobenzene |
29898-32-6 | 98% | 100g |
1,107.00 | 2021-05-17 | |
| XI GE MA AO DE LI QI ( SHANG HAI ) MAO YI Co., Ltd. | 283533-25G |
2,4-Dichloro-1-iodobenzene |
29898-32-6 | 98% | 25G |
¥432.7 | 2022-02-24 | |
| Fluorochem | 001167-25g |
2,4-Dichloroiodobenzene |
29898-32-6 | 98% | 25g |
£28.00 | 2022-03-29 | |
| Fluorochem | 001167-5g |
2,4-Dichloroiodobenzene |
29898-32-6 | 98% | 5g |
£10.00 | 2022-03-29 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | JN605-1g |
2,4-Dichloro-1-iodobenzene |
29898-32-6 | 98.0%(GC) | 1g |
¥109.0 | 2022-06-10 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | JN605-5g |
2,4-Dichloro-1-iodobenzene |
29898-32-6 | 98.0%(GC) | 5g |
¥323.0 | 2022-06-10 | |
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | X10105-1g |
2,4-Dichloro-1-iodobenzene |
29898-32-6 | 98% | 1g |
¥15.0 | 2024-07-18 | |
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | X10105-5g |
2,4-Dichloro-1-iodobenzene |
29898-32-6 | 98% | 5g |
¥25.0 | 2024-07-18 | |
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | X10105-100g |
2,4-Dichloro-1-iodobenzene |
29898-32-6 | 98% | 100g |
¥291.0 | 2024-07-18 | |
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | X10105-25g |
2,4-Dichloro-1-iodobenzene |
29898-32-6 | 98% | 25g |
¥75.0 | 2024-07-18 |
2,4-Dichloro-1-iodobenzene Suppliers
2,4-Dichloro-1-iodobenzene Related Literature
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2. An in-depth study of the azidobenzophenone–anthranil–acridone transformationDavid G. Hawkins,Otto Meth-Cohn J. Chem. Soc. Perkin Trans. 1 1983 2077
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3. 921. The relation between configuration and conjugation in diphenyl derivatives. Part IX. Some tetrachloro-2 : 2′-bridged compoundsD. Muriel Hall,Fatima Minhaj J. Chem. Soc. 1957 4584
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4. Nucleophilic displacement in polyhalogenoaromatic compounds. Part 11. Kinetics of protiodeiodination of iodoarenes in dimethyl sulphoxide–methanolRoger Bolton,Clive Moore,John P. B. Sandall J. Chem. Soc. Perkin Trans. 2 1982 1593
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5. CLXI.—The interaction of alkali sulphites with some halogeno-compounds, and the optical resolution of α-phenylpropanesulphonic acidEric Bertram Evans,Ernest Edward Mabbott,Eustace Ebenezer Turner J. Chem. Soc. 1927 1159
Additional information on 2,4-Dichloro-1-iodobenzene
2,4-Dichloro-1-iodobenzene (CAS 29898-32-6): Properties, Applications, and Market Insights
2,4-Dichloro-1-iodobenzene (CAS 29898-32-6) is a halogenated aromatic compound with significant importance in organic synthesis and pharmaceutical intermediates. This compound, also known as 1-iodo-2,4-dichlorobenzene, features a benzene ring substituted with two chlorine atoms and one iodine atom, offering unique reactivity for cross-coupling reactions. Its molecular formula is C6H3Cl2I, and it typically appears as a white to pale yellow crystalline solid with a molecular weight of 273.89 g/mol.
The chemical properties of 2,4-dichloro-1-iodobenzene make it a valuable building block in modern synthetic chemistry. Researchers frequently utilize its iodo-substituted benzene structure in Suzuki-Miyaura and Stille coupling reactions, which are pivotal for creating complex biaryl structures. Recent trends in green chemistry applications have highlighted its role in developing more sustainable synthetic pathways, aligning with the growing demand for eco-friendly chemical processes.
In pharmaceutical research, CAS 29898-32-6 serves as a key intermediate for various drug discovery programs. Its unique halogen pattern enables selective functionalization, making it particularly useful in developing heterocyclic compounds with potential biological activity. The compound's stability under various reaction conditions has made it a favorite among medicinal chemists working on small molecule therapeutics and drug candidate optimization.
The material science field has also found applications for 2,4-dichloro-1-iodobenzene in the synthesis of advanced organic materials. Its incorporation into π-conjugated systems contributes to the development of organic semiconductors and OLED materials, addressing current industry needs for more efficient display technologies. This aligns perfectly with the booming demand for flexible electronics and next-generation optoelectronic devices.
From a commercial perspective, the global market for halogenated benzene derivatives like 2,4-dichloro-1-iodobenzene has shown steady growth, driven by increasing R&D activities in pharmaceuticals and specialty chemicals. Manufacturers have optimized production processes to meet the rising demand while maintaining high purity standards (>98%), which is crucial for sensitive applications. Current market analysis suggests particular growth in the Asia-Pacific region, where pharmaceutical outsourcing has expanded significantly.
Quality control for CAS 29898-32-6 typically involves rigorous analytical techniques including GC-MS, HPLC, and 1H/13C NMR spectroscopy. These methods ensure the absence of common impurities such as dichlorobenzene isomers or iodination byproducts, which could affect downstream applications. Storage recommendations generally include protection from light in cool, dry conditions to maintain stability over extended periods.
Recent innovations in catalytic halogenation methods have improved the synthesis of 2,4-dichloro-1-iodobenzene, reducing waste generation and enhancing atom economy. These advancements respond to the chemical industry's focus on sustainable manufacturing practices and green chemistry principles, topics that currently dominate scientific discourse and industrial priorities.
Safety considerations for handling 1-iodo-2,4-dichlorobenzene follow standard laboratory protocols for halogenated compounds. While not classified as highly hazardous, proper personal protective equipment including gloves and eye protection is recommended. The compound's environmental fate and ecotoxicological profile have been studied to ensure compliance with global chemical regulations such as REACH.
Future research directions for 2,4-dichloro-1-iodobenzene derivatives may explore their potential in metal-organic frameworks (MOFs) and covalent organic frameworks (COFs), emerging areas in materials science. The compound's ability to participate in various coupling reactions while maintaining structural integrity makes it attractive for designing novel porous materials with tailored properties.
For researchers sourcing CAS 29898-32-6, current market offerings include various packaging options from laboratory-scale quantities (100mg-25g) to bulk industrial amounts (1kg+). Leading suppliers provide comprehensive technical data sheets and certificates of analysis to support quality assurance in diverse applications. The compound's relatively stable shelf life (typically 2+ years when stored properly) makes it a practical choice for inventory planning.
Academic interest in polyhalogenated benzene compounds continues to grow, with 2,4-dichloro-1-iodobenzene frequently appearing in recent literature about C-H activation methodologies and transition metal catalysis. These cutting-edge applications demonstrate the compound's ongoing relevance in advancing synthetic chemistry techniques.
In analytical chemistry, derivatives of 2,4-dichloro-1-iodobenzene have shown utility as chromatographic standards and mass spectrometry references, particularly in environmental analysis of halogenated organic compounds. This application benefits from the compound's distinctive fragmentation pattern and good ionization characteristics.
The pricing dynamics for CAS 29898-32-6 reflect typical factors affecting specialty chemicals: purity grade, packaging size, and supplier capabilities. Recent market fluctuations in iodine prices have had some impact, but efficient synthetic routes have helped maintain reasonable cost levels for research and industrial users. Bulk purchasers can often negotiate favorable terms with manufacturers, especially for consistent, long-term demand.
Emerging regulatory considerations for halogenated organic intermediates may influence future production and use patterns of 2,4-dichloro-1-iodobenzene. Proactive environmental assessments and lifecycle analyses are becoming increasingly important for maintaining compliance with evolving international chemical management frameworks.
For synthetic chemists, the ortho- and para-chloro substituents in 1-iodo-2,4-dichlorobenzene offer interesting possibilities for regioselective transformations. Recent publications demonstrate innovative approaches to selectively modify specific halogen positions, expanding the compound's utility in complex molecule construction. These developments align well with pharmaceutical industry needs for diverse building blocks.
Transport and logistics for 2,4-dichloro-1-iodobenzene follow standard chemical shipping protocols. While not subject to stringent hazardous material regulations, proper labeling and documentation ensure smooth international transactions. Many suppliers now offer expedited shipping options to meet urgent research timelines, reflecting the compound's importance in time-sensitive projects.
Looking ahead, the versatility of CAS 29898-32-6 suggests continued relevance across multiple chemistry-driven industries. Its balanced reactivity profile, commercial availability, and well-characterized properties position it as a reliable choice for both established applications and innovative research directions in synthetic and materials chemistry.
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