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1-Methyl-4-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonyl]piperazine | CAS No. 914610-39-2

1-Methyl-4-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonyl]piperazine

Basic Information

Chemical_Structure_Of
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CAS Number

914610-39-2

Molecular Formula

C17H27BN2O4S

Molecular Weight

366.29 g/mol

AD

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids
Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds
Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates
Fine Chemicals Dyes and Pigments Organic Dyes
Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

SMILES

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B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C

InChI

InChI=1S/C17H27BN2O4S/c1-16(2)17(3,4)24-18(23-16)14-6-8-15(9-7-14)25(21,22)20-12-10-19(5)11-13-20/h6-9H,10-13H2,1-5H3

InChIKey

TZMSTBRAQGYDJI-UHFFFAOYSA-N

LogP

0.9219000000000008

Topological Polar Surface Area

59.080000000000005 Ų

Hydrogen Bond Donor/Acceptor

0 / 6

Complexity

558

Synonyms & References

English

  • 1-methyl-4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]sulfonylpiperazine
  • 1-methyl-4-((4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)sulfonyl)piperazine
  • 1-methyl-4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenylsulfonyl)piperazine
  • 4-(4-METHYLPIPERAZIN-1-YLSULFONYL)PHENYLBORONIC ACID PINACOL ESTER
  • 1-Methyl-4-{[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-sulphonyl}piperazine
  • MB07550
  • C-2023
  • SureCN299040
  • 1-methyl-4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]sulfonyl-piperazine
  • 1-methyl-4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prienylsulfonyl)-piperazine
  • 1-methyl-4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenylsulfonyl]piperazine
  • 1-Methyl-4-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonyl]piperazine
  • 1-Methyl-4-[[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]sulfonyl]piperazine (ACI)
  • 1-methyl-4-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonyl]piperazine
  • 1-Methyl-4-((4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)sulfonyl)piperazine
  • CS-0058030
  • 1-Methyl-4-[4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-benzenesulfonyl]-piperazine
  • AKOS025291264
  • 1-Methyl-4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzene-1-sulfonyl]piperazine
  • TZMSTBRAQGYDJI-UHFFFAOYSA-N
  • 1-METHYL-4-(4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYLSULFONYL)PIPERAZINE
  • DB-301503
  • SCHEMBL299040
  • P10745
  • MFCD09746210
  • 1-Methyl-4-[[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]sulfonyl]piperazine
  • 914610-39-2
  • 1-Methyl-4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenylsulfonyl]piperazine
  • DTXSID40631054
  • 1-methyl-4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonyl]piperazine
  • AS-3132

MDL Number

MFCD09746210

Customs Code

2934999090

FAQ

What are the physical and chemical properties of 1-Methyl-4-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonyl]piperazine (CAS: 914610-39-2)?
1-Methyl-4-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonyl]piperazine is a colorless solid with a molecular weight of approximately 582.6 g/mol. It has a solubility of 2.5 g/L in water and exhibits good solubility in organic solvents. This compound is known for its high reactivity, particularly towards nucleophiles. It is commonly used in medicinal chemistry and organic synthesis due to its versatile reactivity and structural complexity.

How is 1-Methyl-4-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonyl]piperazine (CAS: 914610-39-2) typically synthesized?
1-Methyl-4-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonyl]piperazine is typically synthesized via the coupling of 4-bromobenzene sulfonyl chloride with 1-methylpiperazine in the presence of a borate ester and a catalytic amount of a palladium complex, such as Pd(PPh3)4. The reaction is carried out under mild conditions, leading to high yields and good selectivity.

What industries use 1-Methyl-4-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonyl]piperazine (CAS: 914610-39-2)?
1-Methyl-4-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonyl]piperazine is primarily used in pharmaceuticals and medicinal chemistry due to its structural complexity and reactivity. It is also relevant in the synthesis of materials for polymers and sensors. This compound can be used as a key intermediate in the development of new drugs and in the creation of advanced materials.

What precautions should be taken when handling 1-Methyl-4-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonyl]piperazine (CAS: 914610-39-2)?
When handling 1-Methyl-4-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonyl]piperazine (CAS: 914610-39-2), it is crucial to use personal protective equipment (PPE) such as gloves, goggles, and a lab coat. The compound should be handled in a well-ventilated area or a fume hood to minimize inhalation risks. In case of a spill, immediately clean up with appropriate absorbent materials and follow standard laboratory safety procedures. Always consult the Safety Data Sheet (SDS) for detailed information on handling and storage.

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Supplier Information

1-Methyl-4-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonyl]piperazine — Shanghai Yuyeh Biotechnology Co., Ltd.

Shanghai Yuyeh Biotechnology Co., Ltd.

CAS Number: 914610-39-2

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ShangHaiZhaoYun Biotechnology Co Ltd

CAS Number: 914610-39-2

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ShangHaiJiangLuYiYao Technology Co Ltd

CAS Number: 914610-39-2

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Shanghai Tengzhun BioScience Co., Ltd.

CAS Number: 914610-39-2

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1-Methyl-4-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonyl]piperazine — Beijing Bailingwei Technology Co., Ltd.

Beijing Bailingwei Technology Co., Ltd.

CAS Number: 914610-39-2

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Shanghai Jieshukai Biotechnology Co., Ltd.

CAS Number: 914610-39-2

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1-Methyl-4-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonyl]piperazine — JiangSuAiKangShengWuYiYaoYanFa Co Ltd

JiangSuAiKangShengWuYiYaoYanFa Co Ltd

CAS Number: 914610-39-2

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HuBeiGuoYunFuRui Technology Co Ltd

CAS Number: 914610-39-2

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Hubei Hanwei Chemical Co., Ltd.

CAS Number: 914610-39-2

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Shanghai Hansi Chemical Co., Ltd.

CAS Number: 914610-39-2

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1-Methyl-4-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonyl]piperazine — Shanghai Yinxin Laboratory Equipment Co., Ltd.

Shanghai Yinxin Laboratory Equipment Co., Ltd.

CAS Number: 914610-39-2

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