ChemicalBook--->CAS DataBase List--->1049004-32-1

1049004-32-1

1049004-32-1 Structure

1049004-32-1 Structure
IdentificationBack Directory
[Name]

4-(4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLAN-2-YL)CYCLOHEX-3-ENE-1-CARBOXYLIC ACID ETHYL ESTER
[CAS]

1049004-32-1
[Synonyms]

Ethyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)
1-Ethoxycarbonylcyclohex-3-ene-4-boronic acid pinacol ester
4-(Ethoxycarbonyl)cyclohexene-1-boronic acid, pinacol ester
4-(ETHOXY(HYDROXY)BORYL)CYCLOHEX-3-ENECARBOXYLATE PINACOL ESTER
4-(Ethoxycarbonyl)cyclohexene-1-boronic acid, pinacol ester 97%
Ethyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-cycl...
ethyl 4-(hydroxy((3-hydroxy-2,3-dimethylbutan-2-yl)oxy)boryl)cyclohex-
ethyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)cyclohex-3-enecarboxylate
ethyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)cyclohex-3-ene-1-carboxylate
Ethyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-cyclohexene-1-carboxylate
ethyl 4-(hydroxy((3-hydroxy-2,3-dimethylbutan-2-yl)oxy)boryl)cyclohex-3-enecarboxylate
4-(4,4,5,5-TetraMethyl-[1,3,2]dioxaborolan-2-yl)-cyclohex-3-enecarboxylic acid ethyl ester
4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-Cyclohexene-1-carboxylic acid ethyl ester
4-(4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLAN-2-YL)CYCLOHEX-3-ENE-1-CARBOXYLIC ACID ETHYL ESTER
3-Cyclohexene-1-carboxylic acid, 4-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)-, ethyl ester
[Molecular Formula]

C15H25BO4
[MDL Number]

MFCD11520546
[MOL File]

1049004-32-1.mol
[Molecular Weight]

280.17
Chemical PropertiesBack Directory
[Boiling point ]

312.6±52.0 °C(Predicted)
[density ]

1.03
[storage temp. ]

Inert atmosphere,2-8°C
[form ]

Liquid
[color ]

Colorless to light yellow
[InChI]

InChI=1S/C15H25BO4/c1-6-18-13(17)11-7-9-12(10-8-11)16-19-14(2,3)15(4,5)20-16/h9,11H,6-8,10H2,1-5H3
[InChIKey]

ZREZDODZGZVRBD-UHFFFAOYSA-N
[SMILES]

C1(C(OCC)=O)CCC(B2OC(C)(C)C(C)(C)O2)=CC1
Safety DataBack Directory
[Symbol(GHS) ]


GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P280-P261
[HS Code ]

2931900090
Hazard InformationBack Directory
[Uses]

4-(Ethoxycarbonyl)cyclohexene-1-boronic acid, pinacol ester
[Synthesis]

ethyl 4-(trifluoromethylsulfonyloxy)cyclohex-3-enecarboxylate

122948-57-6

Bis(pinacolato)diboron

73183-34-3

4-(4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLAN-2-YL)CYCLOHEX-3-ENE-1-CARBOXYLIC ACID ETHYL ESTER

1049004-32-1

Ethyl 4-((trifluoromethanesulfonyl)oxy)-3-cyclohexene-1-carboxylate (303 mg, 1 mmol) and pinacol ester of bis(boronic acid) (370 mg, 1.5 mmol) were added to KOAc (400 mg, 4 mmol) and Pd(dppf)Cl2 (10 mg, 0.05 mmol) in dioxane (5 mL). The reaction mixture was heated at 110 °C for 16 hours. After completion of the reaction, it was cooled to room temperature and the mixture was partitioned between EtOAc (10 mL) and saturated NaHCO3 solution (10 mL). The aqueous phase was extracted with EtOAc (10 mL × 2). The combined organic phases were washed with brine, dried over anhydrous MgSO4, filtered, and concentrated. Purification by fast chromatography (25% EtOAc in petroleum ether solution) afforded ethyl 4-boronic acid pinacol ester-3-cyclohexenecarboxylate (250 mg, 89% yield).LRMS m/z (M + H)+: 281 (measured value), 281 (calculated value).

[References]

[1] Patent: WO2014/81619, 2014, A1. Location in patent: Page/Page column 128
[2] Patent: US2011/251183, 2011, A1. Location in patent: Page/Page column 18
[3] Patent: US2011/263578, 2011, A1. Location in patent: Page/Page column 34
[4] Patent: WO2011/128265, 2011, A1. Location in patent: Page/Page column 34
[5] Patent: US2011/275801, 2011, A1. Location in patent: Page/Page column 49
Spectrum DetailBack Directory
[Spectrum Detail]

4-(4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLAN-2-YL)CYCLOHEX-3-ENE-1-CARBOXYLIC ACID ETHYL ESTER(1049004-32-1)1HNMR
1049004-32-1 suppliers list
Company Name: Capot Chemical Co.,Ltd.
Tel: +86-(0)57185586718; +8613336195806 , +8613336195806
Website: http://www.capot.com
Company Name: ATK CHEMICAL COMPANY LIMITED
Tel: +undefined-21-51877795
Website: www.atkchemical.com
Company Name: career henan chemical co
Tel: +86-0371-86658258 +8613203830695 , +8613203830695
Website: www.coreychem.com/
Company Name: Accela ChemBio Inc.
Tel: +1-858-6993322
Website: www.accelachem.com/
Company Name: CONIER CHEM AND PHARMA LIMITED
Tel: +8618523575427 , +8618523575427
Website: http://www.conier.com/
Company Name: Jinan Liheng Biotechnology Co., Ltd.
Tel: 15865262812
Website: www.chemicalbook.com/ShowSupplierProductsList1320706/0_EN.htm
Company Name: Antai Fine Chemical Technology Co.,Limited
Tel: 18503026267 , 18503026267
Website: www.chemicalbook.com/ShowSupplierProductsList1980510/0_EN.htm
Company Name: Guangzhou Yuheng Pharmaceutical Technology Co., Ltd
Tel: +8613580539051 , +8613580539051
Website: www.yuhengpharm.com
Company Name: Zhengzhou Alfa Chemical Co.,Ltd
Tel: +8618530059196 , +8618530059196
Website: www.chemicalbook.com/manufacturer/zhengzhou-alfa-chemical-276/
Company Name: Zhejiang J&C Biological Technology Co.,Limited
Tel: +1-2135480471
Website: https://www.sarms4muscle.com
Company Name: Labnetwork lnc.
Tel: +86-27-50766799 +8618062016861 , +8618062016861
Website: www.labnetwork.com
Company Name: Nanjing Hengbei Chemicals Co., Ltd.
Tel: +86-25-58393656
Website: www.hengbeichem.cn
Company Name: Hefei TNJ Chemical Industry Co.,Ltd.
Tel: +86-0551-65418684 +8618949823763 , +8618949823763
Website: www.tnjchem.com
Company Name: HANGZHOU LEAP CHEM CO., LTD.
Tel: +86-571-87711850
Website: www.leapchem.com
Company Name: Changzhou AniKare Pharmatech Co., Ltd.
Tel: +86-0519-8359-8696 +8618018249389 , +8618018249389
Website: http://www.anikare.cn/index_en.html
Company Name: Shanghai Scochem Technology Co., Ltd
Tel: +86-021-33758897 +86-13701882790 , +86-13701882790
Website: www.scochem.com
Company Name: Aladdin Scientific
Tel:
Website: www.aladdinsci.com/
Company Name: Suzhou ARTK Medchem Co., Ltd.
Tel: +86-512-68323658 +86-18168183658 , +86-18168183658
Website:
Tags:1049004-32-1 Related Product Information
627525-96-6 517920-59-1 377780-72-8 928664-98-6 1198615-87-0 955929-54-1 1256781-64-2 797762-23-3

  • HomePage | Member Companies | Advertising | Contact us | Previous WebSite | MSDS | CAS Index | CAS DataBase | Privacy | Terms | About Us
  • All products displayed on this website are only for non-medical purposes such as industrial applications or scientific research, and cannot be used for clinical diagnosis or treatment of humans or animals. They are not medicinal or edible.
    According to relevant laws and regulations and the regulations of this website, units or individuals who purchase hazardous materials should obtain valid qualifications and qualification conditions.
  • Copyright © 2023 ChemicalBook All rights reserved.