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Structure

3-(Hydroxyimino)methylphenylboronic acid

CAS
938443-32-4
Catalog Number
ACM938443324
Category
Boronic Acids

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What is the molecular formula of 3-(Hydroxyimino)methylphenylboronic acid?

The molecular formula is C7H8BNO3.

What is the molecular weight of 3-(Hydroxyimino)methylphenylboronic acid?

The molecular weight is 164.96 g/mol.

What is the IUPAC name of 3-(Hydroxyimino)methylphenylboronic acid?

The IUPAC name is [3-[(E)-hydroxyiminomethyl]phenyl]boronic acid.

What is the InChI of 3-(Hydroxyimino)methylphenylboronic acid?

The InChI is InChI=1S/C7H8BNO3/c10-8(11)7-3-1-2-6(4-7)5-9-12/h1-5,10-12H/b9-5+.

What is the InChIKey of 3-(Hydroxyimino)methylphenylboronic acid?

The InChIKey is MAJVYIIPEHMBDV-WEVVVXLNSA-N.

What is the canonical SMILES of 3-(Hydroxyimino)methylphenylboronic acid?

The canonical SMILES is B(C1=CC(=CC=C1)C=NO)(O)O.

How many hydrogen bond donor counts does 3-(Hydroxyimino)methylphenylboronic acid have?

It has 3 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does 3-(Hydroxyimino)methylphenylboronic acid have?

It has 4 hydrogen bond acceptor counts.

How many rotatable bond counts does 3-(Hydroxyimino)methylphenylboronic acid have?

It has 2 rotatable bond counts.

What is the topological polar surface area of 3-(Hydroxyimino)methylphenylboronic acid?

The topological polar surface area is 73Ų.

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