3-Amino-2-chloropyridine-5-boronic acid, pinacol ester

• CAS: 1073354-96-7
• Catalog Number: ACM1073354967
• Category: Boronic Esters

Custom Q&A

What is the molecular formula of 3-Amino-2-chloropyridine-5-boronic acid, pinacol ester?

The molecular formula is C11H16BClN2O2.

What is the molecular weight of 3-Amino-2-chloropyridine-5-boronic acid, pinacol ester?

The molecular weight is 254.52 g/mol.

What is the IUPAC name of 3-Amino-2-chloropyridine-5-boronic acid, pinacol ester?

The IUPAC name is 2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-amine.

What is the InChI of 3-Amino-2-chloropyridine-5-boronic acid, pinacol ester?

The InChI is InChI=1S/C11H16BClN2O2/c1-10(2)11(3,4)17-12(16-10)7-5-8(14)9(13)15-6-7/h5-6H,14H2,1-4H3.

What is the InChIKey of 3-Amino-2-chloropyridine-5-boronic acid, pinacol ester?

The InChIKey is OTPWQANCPKJXBK-UHFFFAOYSA-N.

What is the canonical SMILES of 3-Amino-2-chloropyridine-5-boronic acid, pinacol ester?

The canonical SMILES is B1(OC(C(O1)(C)C)(C)C)C2=CC(=C(N=C2)Cl)N.

What is the CAS number of 3-Amino-2-chloropyridine-5-boronic acid, pinacol ester?

The CAS number is 1073354-96-7.

What is the European Community (EC) number of 3-Amino-2-chloropyridine-5-boronic acid, pinacol ester?

The EC number is 689-149-6.

What is the DSSTox Substance ID of 3-Amino-2-chloropyridine-5-boronic acid, pinacol ester?

The DSSTox Substance ID is DTXSID10656451.

Is 3-Amino-2-chloropyridine-5-boronic acid, pinacol ester a covalently-bonded compound?

Yes, it is a covalently-bonded compound with 1 covalently-bonded unit.

Synthetic Use

Upstream Synthesis Route 1

• 588729-99-1
• 73183-34-3

• 1073354-96-7

Reference: [1]ACS Medicinal Chemistry Letters,2016,vol. 7,p. 735 - 740

Downstream Synthesis Route 1

• 195457-53-5
• 1073354-96-7

• 1952236-05-3

Reference: [1]Current Patent Assignee: UNIVERSITY OF MICHIGAN - WO2020/215037, 2020, A1

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