Cas no 1256359-05-3 (5-Fluoro-2-(pyrrolidinomethyl)phenylboronic acid, pinacol ester)
5-Fluoro-2-(pyrrolidinomethyl)phenylboronic acid, pinacol ester Chemical and Physical Properties
Names and Identifiers
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- 1-(4-Fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl)pyrrolidine
- 1-[[4-fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl]pyrrolidine
- 1-{[4-Fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl}pyrrolidine
- F72839
- Pyrrolidine, 1-[[4-fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl]-
- 5-fluoro-2-(pyrrolidinomethyl)phenylboronic acid, pinacol ester
- A890103
- MFCD18087707
- 5-Fluoro-2-(pyrrolidinomethyl)phenylboronic acid pinacol ester
- DTXSID10681945
- DB-296056
- AKOS015999770
- 1256359-05-3
- CS-0174938
- BS-19882
- 5-Fluoro-2-(pyrrolidinomethyl)phenylboronic acid, pinacol ester
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- MDL： MFCD18087707
- Inchi： 1S/C17H25BFNO2/c1-16(2)17(3,4)22-18(21-16)15-11-14(19)8-7-13(15)12-20-9-5-6-10-20/h7-8,11H,5-6,9-10,12H2,1-4H3
- InChI Key： CPMLOZMLPLXSKB-UHFFFAOYSA-N
- SMILES： FC1=CC=C(C(B2OC(C)(C)C(C)(C)O2)=C1)CN1CCCC1
Computed Properties
- Exact Mass: 305.19600
- Monoisotopic Mass: 305.1962374g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 22
- Rotatable Bond Count: 3
- Complexity: 382
- 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: 21.7?2
Experimental Properties
- Density: 1.1±0.1 g/cm3
- Boiling Point: 390.2±37.0 °C at 760 mmHg
- Flash Point: 189.8±26.5 °C
- PSA: 21.70000
- LogP: 2.65860
- Vapor Pressure: 0.0±0.9 mmHg at 25°C
5-Fluoro-2-(pyrrolidinomethyl)phenylboronic acid, pinacol ester Security Information
- Signal Word：warning
- Hazard Statement： H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body
- Warning Statement： P264+P280+P305+P351+P338+P337+P313
- Safety Instruction： H303+H313+H333
- Storage Condition：storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)
5-Fluoro-2-(pyrrolidinomethyl)phenylboronic acid, pinacol ester Customs Data
- HS CODE：2934999090
- Customs Data：
China Customs Code:
2934999090Overview:
2934999090. Other heterocyclic compounds. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%
Declaration elements:
Product Name, component content, use to
Summary:
2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
5-Fluoro-2-(pyrrolidinomethyl)phenylboronic acid, pinacol ester Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | F180685-1g |
5-Fluoro-2-(pyrrolidinomethyl)phenylboronic acid, pinacol ester |
1256359-05-3 | 96% | 1g |
￥617.90 | 2023-09-02 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | F180685-5g |
5-Fluoro-2-(pyrrolidinomethyl)phenylboronic acid, pinacol ester |
1256359-05-3 | 96% | 5g |
￥2162.90 | 2023-09-02 | |
| Alichem | A109004482-10g |
1-(4-Fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl)pyrrolidine |
1256359-05-3 | 95% | 10g |
$570.00 | 2023-09-03 | |
| Fluorochem | 216211-1g |
1-(4-Fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl)pyrrolidine |
1256359-05-3 | 95% | 1g |
￡150.00 | 2022-03-01 | |
| Fluorochem | 216211-5g |
1-(4-Fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl)pyrrolidine |
1256359-05-3 | 95% | 5g |
￡450.00 | 2022-03-01 | |
| Fluorochem | 216211-10g |
1-(4-Fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl)pyrrolidine |
1256359-05-3 | 95% | 10g |
￡750.00 | 2022-03-01 | |
| TRC | F532443-100mg |
5-Fluoro-2-(pyrrolidinomethyl)phenylboronic acid, pinacol ester |
1256359-05-3 | 100mg |
$64.00 | 2023-05-18 | ||
| TRC | F532443-250mg |
5-Fluoro-2-(pyrrolidinomethyl)phenylboronic acid, pinacol ester |
1256359-05-3 | 250mg |
$98.00 | 2023-05-18 | ||
| TRC | F532443-500mg |
5-Fluoro-2-(pyrrolidinomethyl)phenylboronic acid, pinacol ester |
1256359-05-3 | 500mg |
$150.00 | 2023-05-18 | ||
| TRC | F532443-1g |
5-Fluoro-2-(pyrrolidinomethyl)phenylboronic acid, pinacol ester |
1256359-05-3 | 1g |
$207.00 | 2023-05-18 |
5-Fluoro-2-(pyrrolidinomethyl)phenylboronic acid, pinacol ester Related Literature
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Felix Witte,Philipp Rietsch,Nithiya Nirmalananthan-Budau,Florian Weigert,Jan P. G?tze,Ute Resch-Genger,Siegfried Eigler,Beate Paulus Phys. Chem. Chem. Phys., 2021,23, 17521-17529
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
Additional information on 5-Fluoro-2-(pyrrolidinomethyl)phenylboronic acid, pinacol ester
Recent Advances in the Study of 5-Fluoro-2-(pyrrolidinomethyl)phenylboronic acid, pinacol ester (CAS: 1256359-05-3)
The compound 5-Fluoro-2-(pyrrolidinomethyl)phenylboronic acid, pinacol ester (CAS: 1256359-05-3) has recently garnered significant attention in the field of chemical biology and medicinal chemistry. This boronic acid derivative is a key intermediate in the synthesis of various bioactive molecules, particularly in the development of proteasome inhibitors and other therapeutic agents. Recent studies have highlighted its potential in targeted drug delivery and as a versatile building block in organic synthesis.
One of the most notable applications of this compound is in the field of cancer research. A 2023 study published in the Journal of Medicinal Chemistry demonstrated its efficacy as a precursor in the synthesis of novel proteasome inhibitors, which are crucial for the treatment of multiple myeloma and other malignancies. The study revealed that the pinacol ester moiety enhances the stability and bioavailability of the compound, making it a promising candidate for further preclinical development.
In addition to its therapeutic potential, 5-Fluoro-2-(pyrrolidinomethyl)phenylboronic acid, pinacol ester has also been investigated for its role in chemical biology. A recent paper in ACS Chemical Biology detailed its use as a molecular probe for studying enzyme-substrate interactions, particularly in the context of boron-containing compounds. The researchers utilized this compound to elucidate the mechanism of action of certain bacterial enzymes, paving the way for the development of new antibiotics.
Another significant advancement comes from the field of organic synthesis. A 2024 study in Organic Letters reported a novel methodology for the Suzuki-Miyaura cross-coupling reaction using this boronic acid ester. The study demonstrated that the compound's unique structural features facilitate high-yield and stereoselective coupling reactions, which are essential for the synthesis of complex natural products and pharmaceuticals.
Despite these promising developments, challenges remain in the large-scale production and application of 5-Fluoro-2-(pyrrolidinomethyl)phenylboronic acid, pinacol ester. Issues such as solubility and stability under physiological conditions need to be addressed to fully harness its potential. Ongoing research is focused on optimizing its chemical properties and exploring new synthetic routes to overcome these limitations.
In conclusion, 5-Fluoro-2-(pyrrolidinomethyl)phenylboronic acid, pinacol ester (CAS: 1256359-05-3) represents a versatile and valuable compound in chemical biology and medicinal chemistry. Its applications in drug development, chemical probes, and organic synthesis underscore its importance in advancing scientific research. Future studies are expected to further elucidate its mechanisms and expand its utility in various therapeutic and industrial contexts.
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