6-Carbamoylpyridine-3-boronicacidpinacolester

• CAS: 1257553-74-4
• Catalog Number: ACM1257553744
• Category: Boronic Esters

Custom Q&A

What is the molecular formula of 6-Carbamoylpyridine-3-boronic acid pinacol ester?

The molecular formula is C12H17BN2O3.

When was the compound created and modified in PubChem?

It was created on October 30, 2011, and last modified on December 2, 2023.

What is the IUPAC name of 6-Carbamoylpyridine-3-boronic acid pinacol ester?

The IUPAC name is 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxamide.

What is the InChI key of the compound?

The InChI key is NRPJHELKCIKBLE-UHFFFAOYSA-N.

How many hydrogen bond donor counts does the compound have?

It has 1 hydrogen bond donor count.

What is the topological polar surface area of 6-Carbamoylpyridine-3-boronic acid pinacol ester?

The topological polar surface area is 74.4Ų.

How many rotatable bond counts does the compound have?

It has 2 rotatable bond counts.

Does 6-Carbamoylpyridine-3-boronic acid pinacol ester have any defined atom stereocenter counts?

No, it does not have any defined atom stereocenter count.

What is the exact mass and mono-isotopic mass of the compound?

The exact mass and mono-isotopic mass are both 248.1332226 g/mol.

Is the compound canonicalized in PubChem?

Yes, the compound is canonicalized in PubChem.