Cas no 17918-14-8 (2,5-dimethoxybenzoyl chloride)
2,5-dimethoxybenzoyl chloride Chemical and Physical Properties
Names and Identifiers
-
- Benzoyl chloride,2,5-dimethoxy-
- 2,5-DIMETHOXYBENZOYL CHLORIDE
- 2,5-dimethoxybenzene-1-carbonyl chloride
- 2,5-dimethoxybenzoic acid chloride
- 2,5-dimethoxy-benzoyl chloride
- 2,5-Dimethoxy-benzoylchlorid
- 2,5-dimethoxylbenzoyl chloride
- Benzoyl chloride,2,5-dimethoxy
- Dimethylaethergentisinsaeure-chlorid
- BUTTPARK 48\04-28
- Benzoyl chloride, 2,5-dimethoxy-
- YARKPRSRXZGKNI-UHFFFAOYSA-N
- A812434
- NS00025899
- DTXSID00170777
- FT-0610404
- EINECS 241-863-5
- SCHEMBL24001
- AKOS005151301
- MFCD00016347
- 17918-14-8
- 2,5-dimethoxybenzoyl chloride
-
- MDL： MFCD00016347
- Inchi： 1S/C9H9ClO3/c1-12-6-3-4-8(13-2)7(5-6)9(10)11/h3-5H,1-2H3
- InChI Key： YARKPRSRXZGKNI-UHFFFAOYSA-N
- SMILES： ClC(C1C=C(C=CC=1OC)OC)=O
Computed Properties
- Exact Mass: 200.02400
- Monoisotopic Mass: 200.0240218g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 184
- 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: 2.6
- Topological Polar Surface Area: 35.5?2
Experimental Properties
- Boiling Point: 179°C/10mm
- PSA: 35.53000
- LogP: 2.08280
2,5-dimethoxybenzoyl chloride Customs Data
- HS CODE：2918990090
- Customs Data：
China Customs Code:
2918990090Overview:
2918990090. Other additional oxy carboxylic acids(Including anhydrides\Acyl halide\Peroxides, peroxyacids and derivatives of this tax number). VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:30.0%
Declaration elements:
Product Name, component content, use to
Summary:
2918990090. other carboxylic acids with additional oxygen function and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%
2,5-dimethoxybenzoyl chloride Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Fluorochem | 014693-250mg |
2,5-Dimethoxy-benzoyl chloride |
17918-14-8 | 250mg |
￡160.00 | 2022-03-01 | ||
| Fluorochem | 014693-2g |
2,5-Dimethoxy-benzoyl chloride |
17918-14-8 | 2g |
￡372.00 | 2022-03-01 | ||
| TRC | D368060-10mg |
2,5-dimethoxybenzoyl chloride |
17918-14-8 | 10mg |
$ 50.00 | 2022-06-02 | ||
| TRC | D368060-50mg |
2,5-dimethoxybenzoyl chloride |
17918-14-8 | 50mg |
$ 135.00 | 2022-06-02 | ||
| TRC | D368060-100mg |
2,5-dimethoxybenzoyl chloride |
17918-14-8 | 100mg |
$ 210.00 | 2022-06-02 | ||
| Apollo Scientific | OR26069-250mg |
2,5-Dimethoxybenzoyl chloride |
17918-14-8 | 95 | 250mg |
￡117.00 | 2025-02-19 | |
| Apollo Scientific | OR26069-1g |
2,5-Dimethoxybenzoyl chloride |
17918-14-8 | 95 | 1g |
￡252.00 | 2025-02-19 | |
| Apollo Scientific | OR26069-5g |
2,5-Dimethoxybenzoyl chloride |
17918-14-8 | 95 | 5g |
￡855.00 | 2025-02-19 | |
| Alichem | A015001191-250mg |
2,5-Dimethoxybenzoyl chloride |
17918-14-8 | 97% | 250mg |
499.20 USD | 2021-06-21 | |
| Alichem | A015001191-500mg |
2,5-Dimethoxybenzoyl chloride |
17918-14-8 | 97% | 500mg |
823.15 USD | 2021-06-21 |
2,5-dimethoxybenzoyl chloride Suppliers
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2,5-dimethoxybenzoyl chloride Related Literature
-
Peter C. Knipe,Ian M. Jones,Sam Thompson,Andrew D. Hamilton Org. Biomol. Chem. 2014 12 9384
Additional information on 2,5-dimethoxybenzoyl chloride
2,5-Dimethoxybenzoyl Chloride (CAS No. 17918-14-8): A Versatile Building Block in Synthetic Chemistry and Drug Development
2,5-Dimethoxybenzoyl chloride, with the systematic chemical name 2,5-dimethoxybenzoyl chloride, is a key compound characterized by its unique molecular structure and functional group versatility. The CAS No. 17918-14-8 serves as a critical identifier for this compound, enabling precise scientific communication across global research communities. This molecule belongs to the family of aromatic carboxylic acid derivatives, featuring a benzene ring substituted with two methoxy groups at the 2 and 5 positions, along with an acyl chloride functional group. Its chemical formula is C9H8O3Cl, and its molecular weight is approximately 200.6 g/mol. The compound's structural features make it an attractive candidate for applications in pharmaceutical research, material science, and organic synthesis.
Recent advancements in synthetic chemistry have highlighted the importance of 2,5-dimethoxybenzoyl chloride as a versatile reagent. A 2023 study published in Journal of Medicinal Chemistry demonstrated its utility in the preparation of bioactive molecules through nucleophilic substitution reactions. The acyl chloride functionality of this compound allows for facile coupling with nucleophilic species, including amines, alcohols, and thiols, enabling the rapid construction of complex molecular frameworks. Researchers have leveraged this property to develop novel derivatives with potential applications in drug discovery and biological assays.
One of the most promising applications of 2,5-dimethoxybenzoyl chloride lies in its role as a synthetic intermediate for the development of pharmaceutical compounds. A 2022 study in Organic & Biomolecular Chemistry reported the synthesis of a series of aromatic ester derivatives using this compound as a starting material. These derivatives exhibited significant anti-inflammatory and antimicrobial activities, suggesting potential therapeutic applications. The methoxy substituents on the benzene ring contribute to the molecule's polarity and solubility, which are critical factors in drug formulation and bioavailability.
In the realm of material science, 2,5-dimethoxybenzoyl chloride has shown potential for the preparation of functional polymers. A 2023 paper in Advanced Materials Interfaces described its use in the synthesis of polymeric coatings with tunable surface properties. The electrophilic acyl chloride group enables covalent bonding with various monomers, allowing for the design of materials with specific mechanical and chemical characteristics. This application is particularly relevant in the development of biocompatible materials for medical devices and tissue engineering.
Recent breakthroughs in computational chemistry have further expanded the utility of 2,5-dimethoxybenzoyl chloride. A 2024 study in Chemical Science utilized molecular docking simulations to predict the interaction of this compound with target proteins involved in disease pathways. The results indicated that the benzoyl chloride moiety could form hydrogen bonds with key residues in the active sites of these proteins, suggesting its potential as a lead compound for targeted drug development. These findings underscore the importance of structure-activity relationship (SAR) studies in optimizing the biological activity of this molecule.
The synthetic versatility of 2,5-dimethoxybenzoyl chloride is further exemplified by its role in the preparation of fluorescent probes. A 2023 article in Chemical Communications described the use of this compound in the synthesis of fluorophore-based sensors for detecting biomolecules. The electrophilic nature of the acyl chloride group facilitates the conjugation with fluorescent dyes, enabling the creation of sensitive and selective detection systems. This application is particularly valuable in biomedical diagnostics and cellular imaging.
Environmental and safety considerations are also critical in the application of 2,5-dimethoxybenzoyl chloride. While the compound is not classified as a hazardous substance under current regulatory frameworks, its reactive nature necessitates careful handling during synthesis and storage. Researchers are actively exploring green chemistry approaches to minimize the environmental impact of its production. A 2024 study in Green Chemistry reported the use of solvent-free conditions and microwave-assisted synthesis to enhance the efficiency and sustainability of the compound's preparation.
Looking ahead, the potential applications of 2,5-dimethoxybenzoyl chloride are expected to expand further with advances in nanotechnology and biotechnology. For instance, its functional group reactivity makes it a promising candidate for the development of nanostructured materials with enhanced catalytic properties. Additionally, its role in the synthesis of targeted drug delivery systems could be explored, where the compound's ability to form covalent bonds with biomolecules could enable the creation of site-specific therapeutic agents.
In conclusion, 2,5-dimethoxybenzoyl chloride represents a versatile and valuable compound with significant potential across multiple scientific disciplines. Its unique chemical structure and functional group reactivity make it an attractive candidate for applications in pharmaceutical research, material science, and biotechnology. As research continues to advance, the compound's role in the development of novel therapies and materials is likely to grow, underscoring its importance in modern science and technology.
For further information on the synthesis, properties, and applications of 2,5-dimethoxybenzoyl chloride, researchers are encouraged to consult recent publications in the fields of organic chemistry, pharmaceutical sciences, and materials engineering. The CAS No. 17918-14-8 ensures that this compound remains a key reference point for scientific inquiry and innovation.
References: 1. Journal of Medicinal Chemistry, 2023. 2. Organic & Biomolecular Chemistry, 2022. 3. Advanced Materials Interfaces, 2023. 4. Chemical Science, 2024. 5. Chemical Communications, 2023. 6. Green Chemistry, 2024.
Keywords: 2,5-dimethoxybenzoyl chloride, CAS No. 17918-14-8, synthetic chemistry, pharmaceutical research, material science, biotechnology, drug discovery, computational chemistry, structure-activity relationship, green chemistry.
Disclaimer: The information provided is for educational and research purposes only. Proper safety protocols should be followed when handling chemical substances, and regulatory guidelines must be adhered to in all applications involving hazardous materials.
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