2-Pyridinylboronic acid MIDA ester

• CAS: 1104637-58-2
• Catalog Number: ACM1104637582
• Category: Other Products; Boronic Acids
• Molecular Weight: 234.02
• Molecular Formula: C10H11BN2O4
• Synonyms: 2-Pyridinylboronic acid MIDA ester, 1104637-58-2, MolPort-027-835-235, AKOS016009109, AK109837, SC-50413, 4-methyl-8-(pyridin-2-yl)dihydro-4l4,8l4-[1,3,2]oxazaborolo[2,3-b][1,3,2]oxazaborole-2,6(3H,5H)-dione
• IUPAC Name: 1-methyl-5-pyridin-2-yl-4,6-dioxa-1-azonia-5-boranuidabicyclo[3.3.0]octane-3,7-dione
• SMILES: [B-]12([N+](CC(=O)O1)(CC(=O)O2)C)C3=CC=CC=N3
• InChI Key: JCMMQAGYOWKSFX-UHFFFAOYSA-N
• Exact Mass: 234.08100
• H-Bond Acceptor: 6
• H-Bond Donor: 0

Custom Q&A

What is the molecular formula of 2-Pyridinylboronic acid MIDA ester?

The molecular formula of 2-Pyridinylboronic acid MIDA ester is C10H11BN2O4.

What is the molecular weight of 2-Pyridinylboronic acid MIDA ester?

The molecular weight of 2-Pyridinylboronic acid MIDA ester is 234.02 g/mol.

What is the IUPAC name of 2-Pyridinylboronic acid MIDA ester?

The IUPAC name of 2-Pyridinylboronic acid MIDA ester is 5-methyl-1-pyridin-2-yl-2,8-dioxa-5-azonia-1-boranuidabicyclo[3.3.0]octane-3,7-dione.

What is the InChI of 2-Pyridinylboronic acid MIDA ester?

The InChI of 2-Pyridinylboronic acid MIDA ester is InChI=1S/C10H11BN2O4/c1-13-6-9(14)16-11(13,17-10(15)7-13)8-4-2-3-5-12-8/h2-5H,6-7H2,1H3.

What is the InChIKey of 2-Pyridinylboronic acid MIDA ester?

The InChIKey of 2-Pyridinylboronic acid MIDA ester is JCMMQAGYOWKSFX-UHFFFAOYSA-N.

What is the canonical SMILES of 2-Pyridinylboronic acid MIDA ester?

The canonical SMILES of 2-Pyridinylboronic acid MIDA ester is [B-]12([N+](CC(=O)O1)(CC(=O)O2)C)C3=CC=CC=N3.

What is the hydrogen bond donor count of 2-Pyridinylboronic acid MIDA ester?

The hydrogen bond donor count of 2-Pyridinylboronic acid MIDA ester is 0.

What is the hydrogen bond acceptor count of 2-Pyridinylboronic acid MIDA ester?

The hydrogen bond acceptor count of 2-Pyridinylboronic acid MIDA ester is 6.

How many rotatable bonds are there in 2-Pyridinylboronic acid MIDA ester?

There is 1 rotatable bond in 2-Pyridinylboronic acid MIDA ester.

What is the topological polar surface area of 2-Pyridinylboronic acid MIDA ester?

The topological polar surface area of 2-Pyridinylboronic acid MIDA ester is 65.5Ų.