Cas no 131534-65-1 (3-pyridyltrimethyleneborate)
3-pyridyltrimethyleneborate Chemical and Physical Properties
Names and Identifiers
-
- 3-(1,3,2-Dioxaborinan-2-yl)pyridine
- 2-(3-Pyridyl)-1,3,2-dioxaborinane
- 3-Pyridyltrimethylene borate:
- 3-Pyridineboronic acid 1,3-propanediol ester
- PYRIDINE-3-BORONIC ACID 1,3-PROPANEDIOL CYCLIC ESTER
- Pyridine-3-boronic acid 1,3-propanediol ester
- Pyridine-3-boronic acid, propane-1,3-diol cyclic ester
- AKOS BRN-0201
- 3-propanediol cyclic ester
- 1,3-PROPANEDIOL CYCLIC ESTER
- 3-PYRIDYL TRIMETHYLENE BORATE
- 2-(3-PYRIDYL)-1,3,2-DIOXABORANE
- 3-[1,3,2]DIOXABORINAN-2-YL-PYRIDINE
- 3-(1,3,2-DIOXABOROLAN-2-YL) PYRIDINE
- 3-Pyridineboronic acid glycol ester
- 3-Pyridineboronic acid 1,3-propanediol e
- 3-pyridyltrimethyleneborate
- pyrdine-3-boronic acid 1,3-propanediol cyclic ester
- 3-Pyridineboronic acid glycol ester
- 3-Pyridyltrimethylene borate
- AB08194
- 3-pyridine boronic acid 1,3-propanediol cyclic ester
- pyridine-3-boronic acid, 1,3-propanediol cyclic ester
- PYRIDINE,3-(1,3,2-DIOXABORINAN-2-YL)-
- A806278
- FT-0643153
- ZUUZNOFTKGDLLN-UHFFFAOYSA-N
- H12038
- SCHEMBL120847
- DTXSID60400729
- pyridine 3-boronic acid 1,3-propanediol cyclic ester
- 131534-65-1
- 3-pyridine boronic acid 1,3-propanediol ester
- pyridine-3-boronic acid-1,3-propanediol ester
- 3-PYRIDINEBORONIC ACID,1,3-PROPANEDIOL CYCLIC ESTER
- PYRIDINE-3-BORONIC ACID, PROPANE-1,3-DIOL ESTER
- J-006017
- Pyridine, 3-(1,3,2-dioxaborinan-2-yl)-
- AS-63849
- pyridine-3-boronic acid-1,3-propanediol cyclic ester
- CS-0099740
- pyridine-3-boronic acid 1,3-propane diol cyclic ester
- 3-[1.3.2]-dioxaborinan-2-ylpyridine
- AKOS004116474
- 3-Pyridineboronic acid 1,3-propanediol ester, 97%
- MFCD01075749
- DB-042040
- DTXCID60351585
-
- MDL: MFCD01075749
- Inchi: 1S/C8H10BNO2/c1-3-8(7-10-4-1)9-11-5-2-6-12-9/h1,3-4,7H,2,5-6H2
- InChI Key: ZUUZNOFTKGDLLN-UHFFFAOYSA-N
- SMILES: O1B(C2C=NC=CC=2)OCCC1
- BRN: 6138748
Computed Properties
- Exact Mass: 163.08000
- Monoisotopic Mass: 163.08
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 139
- 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: nothing
- Topological Polar Surface Area: 31.4A^2
Experimental Properties
- Color/Form: White or yellow crystalline powder
- Density: 1.1±0.1 g/cm3
- Melting Point: 95-99?°C (lit.)
- Boiling Point: 309.5±15.0 °C at 760 mmHg
- Flash Point: 141.0±20.4 °C
- Refractive Index: 1.497
- PSA: 31.35000
- LogP: 0.21370
- Solubility: Not determined
- Vapor Pressure: 0.0±0.6 mmHg at 25°C
3-pyridyltrimethyleneborate Security Information
- Signal Word:warning
- Hazard Statement: Irritant
- Warning Statement: P264+P280+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: S22-S24/25
-
Hazardous Material Identification:
- Safety Term:S26;S36
- Risk Phrases:R36/37/38
- Storage Condition:storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)
3-pyridyltrimethyleneborate 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%
3-pyridyltrimethyleneborate Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | F-BF364-200mg |
Pyridine-3-boronic acid 1,3-propanediol ester |
131534-65-1 | 98% | 200mg |
¥220.0 | 2022-02-28 | |
| Chemenu | CM172741-10g |
3-(1,3,2-Dioxaborinan-2-yl)pyridine |
131534-65-1 | 0.95 | 10g |
$170 | 2021-06-16 | |
| TRC | P840813-10mg |
3-Pyridyltrimethylene Borate |
131534-65-1 | 10mg |
$ 50.00 | 2022-06-03 | ||
| TRC | P840813-50mg |
3-Pyridyltrimethylene Borate |
131534-65-1 | 50mg |
$ 65.00 | 2022-06-03 | ||
| TRC | P840813-100mg |
3-Pyridyltrimethylene Borate |
131534-65-1 | 100mg |
$ 80.00 | 2022-06-03 | ||
| Chemenu | CM172741-5g |
3-(1,3,2-Dioxaborinan-2-yl)pyridine |
131534-65-1 | 95%+ | 5g |
$116 | 2024-08-02 | |
| Apollo Scientific | OR7260-1g |
Pyridine-3-boronic acid, propane-1,3-diol ester |
131534-65-1 | 1g |
£78.00 | 2023-04-13 | ||
| Apollo Scientific | OR7260-5g |
Pyridine-3-boronic acid, propane-1,3-diol ester |
131534-65-1 | 5g |
£85.00 | 2025-02-20 | ||
| abcr | AB134842-1 g |
Pyridine-3-boronic acid 1,3-propanediol cyclic ester, 98%; . |
131534-65-1 | 98% | 1g |
€63.10 | 2022-06-12 | |
| abcr | AB134842-5 g |
Pyridine-3-boronic acid 1,3-propanediol cyclic ester, 98%; . |
131534-65-1 | 98% | 5g |
€126.80 | 2022-06-12 |
3-pyridyltrimethyleneborate Related Literature
-
A. Matsumoto,A. J. Stephenson-Brown,T. Khan,T. Miyazawa,H. Cabral,K. Kataoka,Y. Miyahara Chem. Sci. 2017 8 6165
-
R. H. Tale,G. K. Toradmal,V. B. Gopula RSC Adv. 2015 5 84910
-
Seokhoon Jang,Kyung Hyung Lee,Jun Yeob Lee,Youngu Lee J. Mater. Chem. C 2019 7 9599
-
Velu Sadhasivam,Muniyasamy Harikrishnan,Ganesan Elamathi,Rajendran Balasaravanan,Sepperumal Murugesan,Ayyanar Siva New J. Chem. 2020 44 6222
-
Bibi Amna,Humaira Masood Siddiqi,Abbas Hassan,Turan Ozturk RSC Adv. 2020 10 4322
Additional information on 3-pyridyltrimethyleneborate
Professional Introduction to 3-pyridyltrimethyleneborate (CAS No. 131534-65-1)
3-pyridyltrimethyleneborate, identified by the Chemical Abstracts Service Number (CAS No.) 131534-65-1, is a specialized boron-containing compound that has garnered significant attention in the field of pharmaceutical chemistry and materials science. This compound, featuring a pyridyl moiety linked to a trimethylene backbone with a borate functionality, exhibits unique electronic and steric properties that make it a valuable intermediate in the synthesis of advanced materials and bioactive molecules.
The structural configuration of 3-pyridyltrimethyleneborate (CAS No. 131534-65-1) imparts distinct characteristics that are highly relevant to modern chemical research. The presence of the pyridyl group enhances its solubility in polar organic solvents while providing a stable aromatic framework, whereas the trimethylene bridge introduces flexibility, allowing for conformational diversity in molecular assemblies. The borate moiety, on the other hand, serves as a versatile handle for further functionalization, enabling the construction of complex architectures with tailored properties.
In recent years, the pharmaceutical industry has shown increasing interest in boron-containing compounds due to their potential as therapeutic agents. Boronate esters, in particular, have been extensively studied for their ability to form stable complexes with biological targets, making them promising candidates for drug development. The pyridyltrimethyleneborate derivative (CAS No. 131534-65-1) is no exception, as it has been explored in several preclinical studies for its bioactivity and pharmacokinetic profile.
One of the most compelling applications of 3-pyridyltrimethyleneborate (CAS No. 131534-65-1) lies in its role as a building block for metal-organic frameworks (MOFs) and covalent organic frameworks (COFs). These materials are renowned for their high surface area, tunable porosity, and exceptional stability under various conditions, making them ideal for applications in catalysis, gas storage, and separation technologies. The incorporation of the pyridyl group into these frameworks enhances their interactions with metal ions or other functional units, thereby improving overall performance.
Recent advancements in computational chemistry have further illuminated the potential of 3-pyridyltrimethyleneborate (CAS No. 131534-65-1) in designing novel molecular systems. Quantum mechanical calculations have revealed that the borate functionality can act as an effective ligand for transition metals, facilitating the formation of stable complexes with unique catalytic activities. These findings have inspired new synthetic strategies aimed at harnessing the reactivity of this compound for industrial applications.
The synthesis of 3-pyridyltrimethyleneborate (CAS No. 131534-65-1) presents both challenges and opportunities for chemists seeking to optimize its production on an industrial scale. Traditional synthetic routes often involve multi-step processes that require stringent control over reaction conditions to ensure high yield and purity. However, emerging methodologies leveraging flow chemistry and microwave-assisted synthesis have demonstrated promise in streamlining these processes while maintaining high efficiency.
In conclusion, 3-pyridyltrimethyleneborate (CAS No. 131534-65-1) represents a fascinating compound with broad utility across multiple scientific disciplines. Its unique structural features and functional versatility make it an indispensable tool for researchers exploring cutting-edge applications in pharmaceuticals, materials science, and catalysis. As our understanding of its properties continues to evolve, it is likely that this compound will play an even more pivotal role in shaping the future of chemical innovation.
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