1-Isoquinolylboronic acid

CAS
1219080-58-6
Catalog Number
ACM1219080586
Category
Boronic Acids

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What is the molecular formula of 1-Isoquinolylboronic acid?

The molecular formula of 1-Isoquinolylboronic acid is C9H8BNO2.

What is the molecular weight of 1-Isoquinolylboronic acid?

The molecular weight of 1-Isoquinolylboronic acid is 172.98 g/mol.

What is the IUPAC name of 1-Isoquinolylboronic acid?

The IUPAC name of 1-Isoquinolylboronic acid is isoquinolin-1-ylboronic acid.

What is the InChI key of 1-Isoquinolylboronic acid?

The InChI key of 1-Isoquinolylboronic acid is RVUIQFODKHOTHQ-UHFFFAOYSA-N.

What is the canonical SMILES of 1-Isoquinolylboronic acid?

The canonical SMILES of 1-Isoquinolylboronic acid is B(C1=NC=CC2=CC=CC=C12)(O)O.

How many hydrogen bond donor counts does 1-Isoquinolylboronic acid have?

1-Isoquinolylboronic acid has 2 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does 1-Isoquinolylboronic acid have?

1-Isoquinolylboronic acid has 3 hydrogen bond acceptor counts.

How many rotatable bond counts does 1-Isoquinolylboronic acid have?

1-Isoquinolylboronic acid has 1 rotatable bond count.

What is the topological polar surface area of 1-Isoquinolylboronic acid?

The topological polar surface area of 1-Isoquinolylboronic acid is 53.4Ų.

How many heavy atom counts does 1-Isoquinolylboronic acid have?

1-Isoquinolylboronic acid has 13 heavy atom counts.

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