Cas no 143230-65-3 (Benzaldehyde, 3-bromo-5-methoxy-4-(2-propynyloxy)-)
Benzaldehyde, 3-bromo-5-methoxy-4-(2-propynyloxy)- Chemical and Physical Properties
Names and Identifiers
-
- Benzaldehyde, 3-bromo-5-methoxy-4-(2-propynyloxy)-
- Oprea1_138304
- SR-01000235730
- BBL024067
- 3-Bromo-5-methoxy-4-(2-propynyloxy)benzaldehyde
- 143230-65-3
- STK198724
- VS-07635
- 3-bromo-5-methoxy-4-(prop-2-yn-1-yloxy)benzaldehyde
- CS-0117285
- starbld0027652
- AKOS000295157
- Oprea1_613556
- SR-01000235730-1
- 3-bromo-5-methoxy-4-prop-2-ynoxybenzaldehyde
- AB00108892-01
-
- Inchi: 1S/C11H9BrO3/c1-3-4-15-11-9(12)5-8(7-13)6-10(11)14-2/h1,5-7H,4H2,2H3
- InChI Key: VTYXTUCZPDRKOD-UHFFFAOYSA-N
- SMILES: BrC1=CC(C=O)=CC(=C1OCC#C)OC
Computed Properties
- Exact Mass: 267.97347
- Monoisotopic Mass: 267.97351g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 4
- Complexity: 258
- 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: 2.1
- Topological Polar Surface Area: 35.5?2
Experimental Properties
- PSA: 35.53
Benzaldehyde, 3-bromo-5-methoxy-4-(2-propynyloxy)- Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1187925-500mg |
3-Bromo-5-methoxy-4-(2-propynyloxy)benzaldehyde |
143230-65-3 | 98% | 500mg |
¥5434.00 | 2024-08-09 | |
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1187925-1g |
3-Bromo-5-methoxy-4-(2-propynyloxy)benzaldehyde |
143230-65-3 | 98% | 1g |
¥8339.00 | 2024-08-09 |
Benzaldehyde, 3-bromo-5-methoxy-4-(2-propynyloxy)- Related Literature
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
Additional information on Benzaldehyde, 3-bromo-5-methoxy-4-(2-propynyloxy)-
Comprehensive Guide to Benzaldehyde, 3-bromo-5-methoxy-4-(2-propynyloxy)- (CAS No. 143230-65-3)
Benzaldehyde, 3-bromo-5-methoxy-4-(2-propynyloxy)- (CAS No. 143230-65-3) is a specialized organic compound that has garnered significant attention in the fields of pharmaceutical research, agrochemical development, and material science. This compound, characterized by its unique bromine and methoxy functional groups, offers a versatile platform for synthetic chemists. Its molecular structure, which includes a propynyloxy side chain, makes it particularly valuable for applications requiring precise molecular modifications.
The growing interest in 3-bromo-5-methoxy-4-(2-propynyloxy)benzaldehyde is driven by its potential in drug discovery and development. Researchers are increasingly exploring its utility as a building block for heterocyclic compounds, which are crucial in designing new therapeutic agents. With the rise of AI-driven drug discovery, compounds like this are being screened for their bioactivity and compatibility with modern computational models. This aligns with the current trend of green chemistry and sustainable synthesis, where efficiency and minimal environmental impact are prioritized.
In the agrochemical sector, Benzaldehyde, 3-bromo-5-methoxy-4-(2-propynyloxy)- is being investigated for its potential as an intermediate in the synthesis of novel pesticides and herbicides. The compound's electrophilic properties make it a candidate for creating targeted formulations that address resistant pest strains. This is particularly relevant given the increasing global focus on food security and sustainable farming practices.
From a material science perspective, the propynyloxy group in this benzaldehyde derivative offers opportunities for click chemistry applications. This has implications for developing advanced polymers, coatings, and adhesives with enhanced performance characteristics. The compound's ability to participate in Huisgen cycloaddition reactions makes it a valuable tool for researchers working on smart materials and nanotechnology.
The synthesis and handling of CAS 143230-65-3 require specialized knowledge due to its reactive functional groups. Proper storage conditions, typically under inert atmosphere and low temperatures, are essential to maintain its stability. Analytical techniques such as HPLC and NMR spectroscopy are commonly employed for purity assessment and structural confirmation.
Market trends indicate a steady demand for 3-bromo-5-methoxy-4-(2-propynyloxy)benzaldehyde, particularly from research institutions and specialty chemical manufacturers. The compound's price and availability can vary depending on purity requirements and order quantities. Recent advancements in flow chemistry have opened new possibilities for its scalable production while maintaining high yields and purity standards.
For researchers considering working with this compound, it's important to consult the latest safety data sheets and literature references. While not classified as hazardous under normal handling conditions, appropriate personal protective equipment should be used when handling the solid or concentrated solutions. The compound's solubility profile (typically soluble in organic solvents like DCM and THF) should be considered when planning synthetic routes.
The future outlook for Benzaldehyde, 3-bromo-5-methoxy-4-(2-propynyloxy)- appears promising, with potential applications emerging in bioconjugation chemistry and medicinal chemistry. As research continues to uncover new reactions and applications for this versatile building block, its importance in synthetic organic chemistry is likely to grow. Researchers are particularly interested in exploring its potential in creating molecular probes for biological studies and diagnostic applications.
For those seeking additional information about CAS 143230-65-3, numerous scientific databases and specialty chemical suppliers provide detailed specifications and references. The compound's unique combination of functional groups makes it a valuable subject for structure-activity relationship studies and methodological development in organic synthesis.
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