1-Methyl-4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine

Basic Information

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CAS Number

747413-21-4

Molecular Formula

C17H27BN2O2

Molecular Weight

302.23 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Melting Point

112-114°C

Boiling Point

419.2℃ at 760 mmHg

Density

1.07

Water Solubility

Insoluble in water.

Flash Point

207.3℃

SMILES

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

InChI

InChI=1S/C17H27BN2O2/c1-16(2)17(3,4)22-18(21-16)14-6-8-15(9-7-14)20-12-10-19(5)11-13-20/h6-9H,10-13H2,1-5H3

InChIKey

RDFJBDMCBVSCFI-UHFFFAOYSA-N

LogP

1.7375999999999994

Topological Polar Surface Area

24.94 Å²

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

370

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

AKOS015903909
4-(4-methylpiperazin-1-yl) phenylboronic acid pinacol ester
J-513553
Z2044826970
(4-(4-METHYLPIPERAZIN-1-YL)PHENYL)BORONIC ACID PINACOL ESTER
1-methyl-4-[4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenyl]piperazine
1-Methyl-4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]piperazine
1-methyl-4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine
DTXSID40592131
AS-2372
FT-0686875
CS-W012121
4-(4-Methylpiperazin-1-yl)phenylboronic acid, pinacol ester
4-(4-Methylpiperazin-1-yl)phenylboronic Acid Pinacol Ester
SCHEMBL19583
SY003842
1-methyl-4-[4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenyl]-piperazine
RB2063
4-(4-METHYL-1-PIPERAZINYL)BENZENEBORONIC ACID PINACOL ESTER
A22640
4-(4-Methylpiperazin-1-yl)phenylboronic acid,pinacol ester
4-(4-METHYL-1-PIPERAZINYL)PHENYLBORONIC ACID PINACOL ESTER
1-Methyl-4[4-(4,4,5,5-tetramethyl-[1,3,2]-dioxaborolan-2-yl)-phenyl]-piperazine
1-METHYL-4-[4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL) PHENYL]PIPERAZINE
MFCD06795650
RDFJBDMCBVSCFI-UHFFFAOYSA-N
EN300-7390362
Piperazine, 1-methyl-4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-
1-METHYL-[4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYL]PIPERAZINE
1-methyl-4-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]piperazine
AC-7064

MDL Number

MFCD06795650

Customs Code

2933599090

FAQ

What regulatory guidelines apply to 1-Methyl-4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine (CAS: 747413-21-4)?

1-Methyl-4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine (CAS: 747413-21-4) falls under the scope of the REACH regulation in the European Union and may require GHS classification for hazardous properties. The FDA and EPA may also have specific requirements for the import and use of this compound in the United States. Users should consult the most current regulatory guidelines for specific details and compliance measures.

Are there alternatives to 1-Methyl-4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine (CAS: 747413-21-4) in synthesis?

Several alternatives to 1-Methyl-4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine (CAS: 747413-21-4) exist in synthesis, including various piperazines and related compounds. Common alternatives include 3-(1-adamantyl)piperazine (3-(1-AdP), CAS: 670-86-4) and 1-(3-aminopropyl)-4-methylpiperazine (PIP, CAS: 629-09-8). These alternatives can serve similar functions in different synthetic pathways.

What is the market or research trend for 1-Methyl-4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine (CAS: 747413-21-4)?

The market for 1-Methyl-4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine (CAS: 747413-21-4) is growing due to increasing research in medicinal chemistry and drug discovery. Emerging trends include its use in developing new therapeutic agents. Additionally, the compound shows promise in materials science applications, driving further research and development in these areas.

How should waste containing 1-Methyl-4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine (CAS: 747413-21-4) be handled?

Waste containing 1-Methyl-4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine (CAS: 747413-21-4) should be collected in appropriate, labeled containers and managed according to local hazardous waste regulations. For safe disposal, it is advisable to use professional waste disposal services. Incineration is a common method, but users should ensure compliance with environmental protection guidelines to minimize environmental impact.