2-(4-Methylpiperizinyl)pyridine-4-boronic acid pinacol ester

• CAS: 832114-09-7
• Catalog Number: ACM832114097
• Category: Boronic Esters
• Molecular Weight: 303.21
• Molecular Formula: C₁₆H₂₆BN₃O₂
• Synonyms: 832114-09-7, 1-methyl-4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]piperazine, 2-(4-methylpiperazin-1-yl)pyridine-4-boronic acid, pinacol ester, 2-(4-Methylpiperazino)pyridine-4-boronic acid pinacol ester, 1-Methyl-4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl)piperazine, 2-(4-Methylpiperazin-1-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine, SureCN586733, AC1MCH67, MolPort-000-157-533, MAY00048, ANW-73341, AKOS015947258, AB22753, AK-84294, KB-15073, AB1007257, B-4640, 2-(4-Methylpiperazino)pyridine-4-boronic acid pinacol ester,, 2-(4-METHYLPIPERAZIN-1-YL)PYRIDIN-4-YLBORONIC ACID PINACOL ESTER, 2-(N-METHYLPIPERAZIN-1-YL)PYRIDINE-4-BORONIC ACID PINACOL ESTER
• IUPAC Name: 1-methyl-4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]piperazine
• Canonical SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(=NC=C2)N3CCN(CC3)C
• InChI Key: CERIBIOLVVNLDM-UHFFFAOYSA-N
• Boiling Point: 435.2ºC at 760 mmHg
• Melting Point: 125.1-126.8ºC
• Flash Point: 217ºC
• Density: 1.1g/cm³
• Exact Mass: 303.21200
• H-Bond Acceptor: 5
• H-Bond Donor: 0
• Safety Description: 26-36

Custom Q&A

What is the molecular formula of 2-(4-Methylpiperizinyl)pyridine-4-boronic acid pinacol ester?

The molecular formula is C16H26BN3O2.

What are the synonyms for 2-(4-Methylpiperizinyl)pyridine-4-boronic acid pinacol ester?

The synonyms include 832114-09-7, 1-Methyl-4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl)piperazine, 1-methyl-4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]piperazine, and more.

What is the molecular weight of 2-(4-Methylpiperizinyl)pyridine-4-boronic acid pinacol ester?

The molecular weight is 303.2 g/mol.

When was 2-(4-Methylpiperizinyl)pyridine-4-boronic acid pinacol ester created?

It was created on July 19, 2005.

What is the InChI of 2-(4-Methylpiperizinyl)pyridine-4-boronic acid pinacol ester?

The InChI is InChI=1S/C16H26BN3O2/c1-15(2)16(3,4)22-17(21-15)13-6-7-18-14(12-13)20-10-8-19(5)9-11-20/h6-7,12H,8-11H2,1-5H3.

What is the InChIKey of 2-(4-Methylpiperizinyl)pyridine-4-boronic acid pinacol ester?

The InChIKey is CERIBIOLVVNLDM-UHFFFAOYSA-N.

What is the canonical SMILES of 2-(4-Methylpiperizinyl)pyridine-4-boronic acid pinacol ester?

The canonical SMILES is B1(OC(C(O1)(C)C)(C)C)C2=CC(=NC=C2)N3CCN(CC3)C.

What is the CAS number of 2-(4-Methylpiperizinyl)pyridine-4-boronic acid pinacol ester?

The CAS number is 832114-09-7.

What is the EC number of 2-(4-Methylpiperizinyl)pyridine-4-boronic acid pinacol ester?

The EC number is 675-073-0.

What is the compound's hydrogen bond donor count?

The compound has 0 hydrogen bond donor count.

Synthetic Use

Downstream Synthesis Route 1

• 832114-09-7
• 1346702-61-1

• 1346704-33-3

Reference: [1] ACS Medicinal Chemistry Letters, 2012, vol. 3, # 12, p. 1091 - 1096

Downstream Synthesis Route 2

• 832114-09-7
• 937046-98-5

• 937048-13-0

Reference: [1]Patent: WO2007/56170,2007,A2 .Location in patent: Page/Page column 150

Downstream Synthesis Route 3

• 832114-09-7
• 1346702-61-1

• 1346704-33-3

Reference: [1]ACS Medicinal Chemistry Letters,2012,vol. 3,p. 1091 - 1096

* For details of the synthesis route, please refer to the original source to ensure accuracy.