- Direct C-H Borylation of Arenes Catalyzed by Saturated Hydride-Boryl-Iridium-POP Complexes: Kinetic Analysis of the Elemental StepsEsteruelas, Miguel A. ; Martinez, Antonio; Olivan, Montserrat; Onate, Enrique, Chemistry - A European Journal, 2020, 26(55), 12632-12644
Cas no 942069-95-6 (3,4,5-Trichlorophenylboronic Acid Pinacol Ester)
942069-95-6 structure
Product Name:3,4,5-Trichlorophenylboronic Acid Pinacol Ester
CAS No:942069-95-6
MF:C12H14BCl3O2
MW:307.408360958099
MDL:MFCD11504973
CID:839807
PubChem ID:46739226
Update Time:2024-10-25
3,4,5-Trichlorophenylboronic Acid Pinacol Ester Chemical and Physical Properties
Names and Identifiers
-
- 4,4,5,5-Tetramethyl-2-(3,4,5-trichlorophenyl)-1,3,2-dioxaborolane
- 3,4,5-TRICHLOROPHENYLBORONIC ACID, PINACOL ESTER
- B-4546
- 4,4,5,5-Tetramethyl-2-(3,4,5-trichlorophenyl)-1,3,2-dioxaborolane (ACI)
- 3,4,5-Trichlorophenylboronic Acid Pinacol Ester
- EN300-233672
- SCHEMBL4789211
- Z2044775789
- AKOS016001184
- MFCD11504973
- BS-23188
- 942069-95-6
- CS-0175544
- DTXSID90674850
- 3,4,5-Trichlorophenylboronic acid,pinacol ester
- 3,4,5-Trichlorophenylboronic Acid Pinacol Ester
-
- MDL: MFCD11504973
- Inchi: 1S/C12H14BCl3O2/c1-11(2)12(3,4)18-13(17-11)7-5-8(14)10(16)9(15)6-7/h5-6H,1-4H3
- InChI Key: OTPVENHYVDCFAO-UHFFFAOYSA-N
- SMILES: ClC1C(Cl)=C(Cl)C=C(B2OC(C)(C)C(C)(C)O2)C=1
Computed Properties
- Exact Mass: 306.01500
- Monoisotopic Mass: 306.015243g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 1
- Complexity: 296
- 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: 18.5?2
Experimental Properties
- PSA: 18.46000
- LogP: 3.94600
3,4,5-Trichlorophenylboronic 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%
3,4,5-Trichlorophenylboronic Acid Pinacol Ester Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Alichem | A019119789-5g |
4,4,5,5-Tetramethyl-2-(3,4,5-trichlorophenyl)-1,3,2-dioxaborolane |
942069-95-6 | 95% | 5g |
$355.68 | 2023-08-31 | |
| Alichem | A019119789-10g |
4,4,5,5-Tetramethyl-2-(3,4,5-trichlorophenyl)-1,3,2-dioxaborolane |
942069-95-6 | 95% | 10g |
$537.68 | 2023-08-31 | |
| Alichem | A019119789-25g |
4,4,5,5-Tetramethyl-2-(3,4,5-trichlorophenyl)-1,3,2-dioxaborolane |
942069-95-6 | 95% | 25g |
$968.24 | 2023-08-31 | |
| Chemenu | CM135991-1g |
4,4,5,5-Tetramethyl-2-(3,4,5-trichlorophenyl)-1,3,2-dioxaborolane |
942069-95-6 | 95% | 1g |
$97 | 2024-07-19 | |
| Apollo Scientific | OR361673-1g |
3,4,5-Trichlorophenylboronic acid, pinacol ester |
942069-95-6 | 96% | 1g |
£64.00 | 2024-07-28 | |
| Apollo Scientific | OR361673-5g |
3,4,5-Trichlorophenylboronic acid, pinacol ester |
942069-95-6 | 96% | 5g |
£152.00 | 2024-07-28 | |
| SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd. | T886774-5g |
3,4,5-Trichlorophenylboronic Acid Pinacol Ester |
942069-95-6 | 98% | 5g |
2,160.00 | 2021-05-17 | |
| abcr | AB273906-250 mg |
3,4,5-Trichlorophenylboronic acid, pinacol ester, 96%; . |
942069-95-6 | 96% | 250mg |
€75.90 | 2023-04-26 | |
| abcr | AB273906-1 g |
3,4,5-Trichlorophenylboronic acid, pinacol ester, 96%; . |
942069-95-6 | 96% | 1g |
€96.80 | 2023-04-26 | |
| abcr | AB273906-5 g |
3,4,5-Trichlorophenylboronic acid, pinacol ester, 96%; . |
942069-95-6 | 96% | 5g |
€177.20 | 2023-04-26 |
3,4,5-Trichlorophenylboronic Acid Pinacol Ester Production Method
Production Method 1
Reaction Conditions
1.1 Catalysts: 2489284-98-0 Solvents: Cyclohexene ; 18 h, 110 °C
Reference
Production Method 2
Reaction Conditions
1.1 Reagents: 4,4′-Bis(1,1-dimethylethyl)-2,2′-bipyridine Catalysts: Bis[(1,2,5,6-η)-1,5-cyclooctadiene]di-μ-methoxydiiridium ; 1 min, rt
1.2 2 h, 80 °C
1.2 2 h, 80 °C
Reference
- Harnessing C-H Borylation/Deborylation for Selective Deuteration, Synthesis of Boronate Esters, and Late Stage FunctionalizationKallepalli, Venkata A.; Gore, Kristin A.; Shi, Feng; Sanchez, Luis; Chotana, Ghayoor A.; et al, Journal of Organic Chemistry, 2015, 80(16), 8341-8353
Production Method 3
Reaction Conditions
1.1 Reagents: 2,6-Bis(1-methylethyl)-N-(2-pyridinylmethylene)benzenamine Catalysts: Di-μ-chlorobis[(1,2,5,6-η)-1,5-cyclooctadiene]diiridium Solvents: Heptane ; < 1 min, rt; 18 h, rt → reflux
Reference
- Preparation of cyanotriazolylphenylisoxazolines as pesticides., World Intellectual Property Organization, , ,
3,4,5-Trichlorophenylboronic Acid Pinacol Ester Raw materials
3,4,5-Trichlorophenylboronic Acid Pinacol Ester Preparation Products
3,4,5-Trichlorophenylboronic Acid Pinacol Ester Related Literature
-
Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
-
Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
-
Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
-
Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
-
Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
942069-95-6 (3,4,5-Trichlorophenylboronic Acid Pinacol Ester) Related Products
- 502630-89-9(1,3,2-Dioxaborolane, 2-(3-chloro-5-methylphenyl)-4,4,5,5-tetramethyl-)
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- 942069-73-0(3,5-Dichloro-4-methylphenylboronic acid, pinacol ester)
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- 445303-10-6(3-Chloro-4-methylphenylboronic acid pinacol ester)
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