3,6-Dihydro-2H-thiopyran-4-ylboronic acid pinacol ester

• CAS: 862129-81-5
• Catalog Number: ACM862129815
• Category: Boronic Esters
• Molecular Weight: 226.14
• Molecular Formula: C₁₁H₁₉BO₂S

Custom Q&A

What is the molecular formula of 3,6-Dihydro-2H-thiopyran-4-ylboronic acid pinacol ester?

The molecular formula is C11H19BO2S.

What is the molecular weight of 3,6-Dihydro-2H-thiopyran-4-ylboronic acid pinacol ester?

The molecular weight is 226.15 g/mol.

What is the IUPAC name of 3,6-Dihydro-2H-thiopyran-4-ylboronic acid pinacol ester?

The IUPAC name is 2-(3,6-dihydro-2H-thiopyran-4-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane.

What is the InChI key of 3,6-Dihydro-2H-thiopyran-4-ylboronic acid pinacol ester?

The InChI key is QZVRTORVCKGPPY-UHFFFAOYSA-N.

What is the canonical SMILES of 3,6-Dihydro-2H-thiopyran-4-ylboronic acid pinacol ester?

The canonical SMILES is B1(OC(C(O1)(C)C)(C)C)C2=CCSCC2.

What is the CAS number of 3,6-Dihydro-2H-thiopyran-4-ylboronic acid pinacol ester?

The CAS number is 862129-81-5.

What is the EC number of 3,6-Dihydro-2H-thiopyran-4-ylboronic acid pinacol ester?

The EC number is 691-334-1.

What is the hydrogen bond donor count of 3,6-Dihydro-2H-thiopyran-4-ylboronic acid pinacol ester?

The hydrogen bond donor count is 0.

What is the hydrogen bond acceptor count of 3,6-Dihydro-2H-thiopyran-4-ylboronic acid pinacol ester?

The hydrogen bond acceptor count is 3.

Is 3,6-Dihydro-2H-thiopyran-4-ylboronic acid pinacol ester a canonicalized compound?

Yes, it is a canonicalized compound.

Synthetic Use

Upstream Synthesis Route 1

• 181180-42-7
• 73183-34-3

• 862129-81-5

Reference: [1] Patent: WO2005/73206, 2005, A1, . Location in patent: Page/Page column 14-15

Upstream Synthesis Route 2

• 76-09-5
• 121-43-7

• 862129-81-5

Reference: [1] Patent: CN105503927, 2016, A, . Location in patent: Paragraph 0015

Upstream Synthesis Route 3

• 121-43-7
• 126-30-7

• 862129-81-5

Reference: [1] Patent: CN105503927, 2016, A, . Location in patent: Paragraph 0016

Upstream Synthesis Route 4

• 181180-42-7
• 73183-34-3

• 862129-81-5

Reference: [1]Patent: WO2005/73206,2005,A1 .Location in patent: Page/Page column 14-15

Upstream Synthesis Route 5

• 1072-72-6

• 862129-81-5

Reference: [1]Bioorganic and Medicinal Chemistry Letters,2007,vol. 17,p. 3544 - 3549
[2]Patent: WO2015/89327,2015,A1
[3]Patent: US2015/284411,2015,A1
[4]Patent: CN105503927,2016,A

Downstream Synthesis Route 1

• 648904-46-5
• 862129-81-5

• 862129-83-7

Reference: [1]Patent: WO2005/73206,2005,A1 .Location in patent: Page/Page column 15-16

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