Cas no 98021-77-3 (methyl 2-bromocyclopropane-1-carboxylate)
methyl 2-bromocyclopropane-1-carboxylate Chemical and Physical Properties
Names and Identifiers
-
- Methyl 2-bromocyclopropanecarboxylate
- 2-Bromo-cyclopropanecarboxylic acid methyl ester
- SB38428
- methyl 2-bromocyclopropane-1-carboxylate
- Methyl 2-bromocyclopropanecarboxylate (ACI)
-
- MDL: MFCD24511088
- Inchi: 1S/C5H7BrO2/c1-8-5(7)3-2-4(3)6/h3-4H,2H2,1H3
- InChI Key: HSVUTKNZCLEVQM-UHFFFAOYSA-N
- SMILES: BrC1CC1C(=O)OC
Computed Properties
- Exact Mass: 177.96294g/mol
- Monoisotopic Mass: 177.96294g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 8
- Rotatable Bond Count: 2
- Complexity: 113
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1
- Topological Polar Surface Area: 26.3
methyl 2-bromocyclopropane-1-carboxylate Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| eNovation Chemicals LLC | D972055-100mg |
2-Bromo-cyclopropanecarboxylic acid methyl ester |
98021-77-3 | 95% | 100mg |
$375 | 2022-11-02 | |
| eNovation Chemicals LLC | D972055-250mg |
2-Bromo-cyclopropanecarboxylic acid methyl ester |
98021-77-3 | 95% | 250mg |
$570 | 2022-11-02 | |
| eNovation Chemicals LLC | D972055-500mg |
2-Bromo-cyclopropanecarboxylic acid methyl ester |
98021-77-3 | 95% | 500mg |
$995 | 2022-11-02 | |
| eNovation Chemicals LLC | D972055-1g |
2-Bromo-cyclopropanecarboxylic acid methyl ester |
98021-77-3 | 95% | 1g |
$1815 | 2022-11-02 | |
| eNovation Chemicals LLC | D972055-5g |
2-Bromo-cyclopropanecarboxylic acid methyl ester |
98021-77-3 | 95% | 5g |
$6760 | 2022-11-02 | |
| Enamine | EN300-270057-0.05g |
methyl 2-bromocyclopropane-1-carboxylate |
98021-77-3 | 95.0% | 0.05g |
$474.0 | 2025-03-20 | |
| Enamine | EN300-270057-0.1g |
methyl 2-bromocyclopropane-1-carboxylate |
98021-77-3 | 95.0% | 0.1g |
$619.0 | 2025-03-20 | |
| Enamine | EN300-270057-0.25g |
methyl 2-bromocyclopropane-1-carboxylate |
98021-77-3 | 95.0% | 0.25g |
$883.0 | 2025-03-20 | |
| Enamine | EN300-270057-0.5g |
methyl 2-bromocyclopropane-1-carboxylate |
98021-77-3 | 95.0% | 0.5g |
$1393.0 | 2025-03-20 | |
| Enamine | EN300-270057-1.0g |
methyl 2-bromocyclopropane-1-carboxylate |
98021-77-3 | 95.0% | 1.0g |
$1785.0 | 2025-03-20 |
methyl 2-bromocyclopropane-1-carboxylate Related Literature
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
Additional information on methyl 2-bromocyclopropane-1-carboxylate
Methyl 2-Bromocyclopropane-1-carboxylate (CAS No. 98021-77-3): Properties, Applications, and Market Insights
Methyl 2-bromocyclopropane-1-carboxylate (CAS No. 98021-77-3) is a specialized organic compound widely used in synthetic chemistry and pharmaceutical research. This brominated cyclopropane derivative is valued for its unique structural properties, making it a versatile intermediate in various chemical reactions. With the increasing demand for cyclopropane derivatives in drug discovery and agrochemical development, this compound has gained significant attention in recent years.
The molecular formula of methyl 2-bromocyclopropane-1-carboxylate is C5H7BrO2, featuring a strained three-membered cyclopropane ring with bromine and ester functional groups. This configuration contributes to its reactivity, particularly in ring-opening reactions and cross-coupling reactions, which are fundamental in modern organic synthesis. Researchers frequently search for "synthesis of methyl 2-bromocyclopropane-1-carboxylate" or "applications of brominated cyclopropanes," reflecting the compound's importance in chemical research.
One of the most significant applications of methyl 2-bromocyclopropanecarboxylate is in the pharmaceutical industry, where it serves as a key building block for active pharmaceutical ingredients (APIs). The strained cyclopropane ring is a common motif in many bioactive molecules, and the bromine atom provides an excellent handle for further functionalization. Recent studies have explored its use in developing antiviral agents and enzyme inhibitors, aligning with current research trends in infectious disease treatment.
In material science, 2-bromocyclopropane-1-carboxylic acid methyl ester has shown potential in polymer modification and specialty chemical synthesis. Its ability to introduce cyclopropane moieties into larger molecules makes it valuable for creating materials with specific mechanical or thermal properties. Industry professionals often inquire about "cyclopropane derivatives in material science" or "brominated ester applications," indicating growing interest in these applications.
The synthesis of methyl 2-bromocyclopropane carboxylate typically involves the bromination of methyl cyclopropanecarboxylate or related precursors. Modern synthetic approaches focus on improving yield and selectivity, with recent literature emphasizing green chemistry principles and catalytic methods. These developments respond to the chemical industry's increasing emphasis on sustainable practices, a topic frequently searched as "sustainable synthesis of cyclopropane derivatives."
From a commercial perspective, the market for methyl 2-bromocyclopropane-1-carboxylate has shown steady growth, particularly in regions with strong pharmaceutical and specialty chemical industries. Suppliers and researchers alike search for "methyl 2-bromocyclopropanecarboxylate price trends" and "reliable suppliers of CAS 98021-77-3," reflecting the compound's commercial importance. The global push for novel drug development continues to drive demand for such specialized intermediates.
Handling and storage of methyl 2-bromocyclopropane carboxylate require standard laboratory precautions for organic bromides. While not classified as highly hazardous, proper ventilation and personal protective equipment are recommended during use. Safety-conscious researchers often look for "handling precautions for bromocyclopropane derivatives" or "stability of methyl 2-bromocyclopropanecarboxylate," demonstrating the importance of safety information in chemical research.
Analytical characterization of methyl 2-bromocyclopropane-1-carboxylate typically involves techniques such as NMR spectroscopy, mass spectrometry, and HPLC. These methods confirm the compound's purity and identity, crucial for research and industrial applications. The search terms "NMR data for methyl 2-bromocyclopropanecarboxylate" and "analytical methods for cyclopropane derivatives" are common among chemists working with this material.
Recent scientific literature has highlighted novel applications of methyl 2-bromocyclopropane-1-carboxylate in medicinal chemistry, particularly in the development of mechanism-based enzyme inhibitors. The compound's ability to form covalent bonds with biological targets makes it valuable for creating irreversible inhibitors, a hot topic in drug discovery. This aligns with frequent searches for "cyclopropane in drug design" and "irreversible enzyme inhibitors."
As research continues to uncover new applications for methyl 2-bromocyclopropanecarboxylate, its importance in synthetic chemistry is expected to grow. The compound represents an excellent example of how small, structurally unique molecules can have significant impacts across multiple scientific disciplines. With ongoing developments in synthetic methodology and expanding applications in life sciences, methyl 2-bromocyclopropane-1-carboxylate (CAS No. 98021-77-3) remains a compound of considerable interest to researchers and industry professionals alike.
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