Cas no 380430-67-1 (2,3,6-Trimethoxyphenylboronic acid)
2,3,6-Trimethoxyphenylboronic acid Chemical and Physical Properties
Names and Identifiers
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- (2,3,6-TRIMETHOXY)BENZENEBORONIC ACID
- (2,3,6-Trimethoxyphenyl)boronic acid
- 2,3,6-Trimethoxyphenylboronic Acid
- 2,3,6-Trimethoxybenzeneboronic acid
- Boronic acid,(2,3,6-trimethoxyphenyl)- (9CI)
- SBB071056
- AB14303
- OR10594
- AX8043937
- X0765
- A25142
- 2,3,6-Trimethoxyphenylboronic acid, AldrichCPR
- 2,3,6-TRIMETHOXYBENZENEBORONIC ACID 95%
- AKOS BRN-0423
- DTXSID40378573
- (2,3,6-trimethoxyphenyl)boronicAcid
- PS-9483
- EN300-7370080
- AKOS004119212
- FT-0656722
- 380430-67-1
- CS-0150632
- H11781
- Z1509570153
- BORONIC ACID, (2,3,6-TRIMETHOXYPHENYL)-(9CI)
- MFCD03411944
- 2,3,6-Trimethoxyphenylboronic acid
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- MDL: MFCD03411944
- Inchi: 1S/C9H13BO5/c1-13-6-4-5-7(14-2)9(15-3)8(6)10(11)12/h4-5,11-12H,1-3H3
- InChI Key: PBJYOPCURLYSAG-UHFFFAOYSA-N
- SMILES: O(C)C1C(=CC=C(C=1B(O)O)OC)OC
Computed Properties
- Exact Mass: 212.08600
- Monoisotopic Mass: 212.086
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 15
- Rotatable Bond Count: 4
- Complexity: 189
- 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: 68.2
Experimental Properties
- Density: 1.2±0.1 g/cm3
- Melting Point: 34-40℃
- Boiling Point: 405.7℃/760mmHg
- Flash Point: 199.1±31.5 °C
- Refractive Index: 1.513
- PSA: 68.15000
- LogP: -0.60780
- Vapor Pressure: 0.0±1.0 mmHg at 25°C
2,3,6-Trimethoxyphenylboronic acid Security Information
- Signal Word:warning
- Hazard Statement: Irritant
-
Warning Statement:
P264Thoroughly clean after treatment
P280Wear protective gloves/Wear protective clothing/Wear protective goggles/Wear a protective mask
P305If it enters the eyes
P351Rinse carefully with water for a few minutes
P338Remove the contact lens(If any)And easy to operate,Continue flushing
P337If eye irritation persists
P313Obtain medical advice/care - Safety Instruction: H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body
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Hazardous Material Identification:
- Storage Condition:storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)
2,3,6-Trimethoxyphenylboronic acid Customs Data
- HS CODE:2931900090
- Customs Data:
China Customs Code:
2931900090Overview:
2931900090. Other organic-Inorganic compound. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:AB(Customs clearance form for Inbound Goods,Customs clearance form for outbound goods). MFN tariff:6.5%. general tariff:30.0%
Summary:
2931900090. other organo-inorganic compounds. VAT:17.0%. Tax rebate rate:13.0%. Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward). MFN tariff:6.5%. General tariff:30.0%
2,3,6-Trimethoxyphenylboronic acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Alichem | A019118879-10g |
(2,3,6-Trimethoxyphenyl)boronic acid |
380430-67-1 | 95% | 10g |
$410.97 | 2023-09-02 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B-AV287-200mg |
2,3,6-Trimethoxyphenylboronic acid |
380430-67-1 | 95+% | 200mg |
204.0CNY | 2021-08-03 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B-AV287-5g |
2,3,6-Trimethoxyphenylboronic acid |
380430-67-1 | 95+% | 5g |
2826CNY | 2021-05-08 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B-AV287-1g |
2,3,6-Trimethoxyphenylboronic acid |
380430-67-1 | 95+% | 1g |
716.0CNY | 2021-08-03 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B-AV287-50mg |
2,3,6-Trimethoxyphenylboronic acid |
380430-67-1 | 95+% | 50mg |
107.0CNY | 2021-08-04 | |
| Apollo Scientific | OR10594-250mg |
2,3,6-Trimethoxybenzeneboronic acid |
380430-67-1 | 95% | 250mg |
£15.00 | 2025-02-19 | |
| Ambeed | A102324-250mg |
(2,3,6-Trimethoxyphenyl)boronic acid |
380430-67-1 | 95% | 250mg |
$26.0 | 2025-02-21 | |
| Ambeed | A102324-1g |
(2,3,6-Trimethoxyphenyl)boronic acid |
380430-67-1 | 95% | 1g |
$63.0 | 2025-02-21 | |
| Ambeed | A102324-5g |
(2,3,6-Trimethoxyphenyl)boronic acid |
380430-67-1 | 95% | 5g |
$256.0 | 2025-02-21 | |
| TRC | T797410-10mg |
2,3,6-Trimethoxyphenylboronic Acid |
380430-67-1 | 10mg |
$ 50.00 | 2022-06-02 |
2,3,6-Trimethoxyphenylboronic acid Related Literature
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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2. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
-
Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
-
Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
Additional information on 2,3,6-Trimethoxyphenylboronic acid
Comprehensive Overview of 2,3,6-Trimethoxyphenylboronic Acid (CAS No. 380430-67-1): Properties, Applications, and Industry Insights
2,3,6-Trimethoxyphenylboronic acid (CAS No. 380430-67-1) is a specialized boronic acid derivative widely recognized for its role in organic synthesis and pharmaceutical research. With the molecular formula C9H13BO5, this compound features a phenyl ring substituted with three methoxy groups at the 2, 3, and 6 positions, along with a boronic acid functional group. Its unique structure makes it a valuable building block for Suzuki-Miyaura cross-coupling reactions, a topic frequently searched by chemists exploring palladium-catalyzed reactions.
The growing demand for 2,3,6-Trimethoxyphenylboronic acid is driven by its applications in drug discovery, particularly in the synthesis of biologically active molecules. Researchers often inquire about its solubility (e.g., in THF or DMSO) and stability under various conditions, as these factors are critical for reaction optimization. Recent studies highlight its utility in developing anticancer agents and enzyme inhibitors, aligning with the trending focus on targeted therapies and precision medicine.
From an industrial perspective, CAS 380430-67-1 is gaining traction due to its compatibility with green chemistry principles. Questions about scalable synthesis methods or eco-friendly purification techniques reflect the market's shift toward sustainable practices. Analytical data, such as NMR spectra (1H/13C) and HPLC purity, are also highly sought after, as evidenced by frequent searches in academic and patent literature.
Beyond pharmaceuticals, 2,3,6-Trimethoxyphenylboronic acid is explored in material science for designing organic electronic components. Its ability to form stable covalent bonds with diols (via boronate ester formation) makes it relevant for sensor development, a hot topic in wearable technology and diagnostic devices. Users often search for storage recommendations (e.g., inert atmosphere, low temperature) to maintain its reactivity.
Quality control is another critical aspect, with frequent queries about certificates of analysis (CoA) and supplier reliability. The compound’s melting point (~100–105°C) and spectroscopic properties are key identifiers for verification. As the industry moves toward AI-assisted molecular design, computational studies on its electronic structure and reactivity descriptors are emerging as a niche research area.
In summary, 2,3,6-Trimethoxyphenylboronic acid (CAS No. 380430-67-1) bridges multiple disciplines, from medicinal chemistry to advanced materials. Its versatility and alignment with cutting-edge research trends ensure its continued relevance in scientific and industrial applications.
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