Structure

2-Bromo-6-fluoro-3-hydroxyphenylboronic acid

CAS
1451392-83-8
Catalog Number
ACM1451392838
Category
Boronic Acids

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What is the molecular formula of 2-Bromo-6-fluoro-3-hydroxyphenylboronic acid?

The molecular formula is C6H5BBrFO3.

When was 2-Bromo-6-fluoro-3-hydroxyphenylboronic acid created?

It was created on August 8, 2012.

What is the computed IUPAC name of the compound?

The computed IUPAC name is (2-bromo-6-fluoro-3-hydroxyphenyl)boronic acid.

What is the InChI of 2-Bromo-6-fluoro-3-hydroxyphenylboronic acid?

The InChI is InChI=1S/C6H5BBrFO3/c8-6-4(10)2-1-3(9)5(6)7(11)12/h1-2,10-12H.

What is the InChIKey of 2-Bromo-6-fluoro-3-hydroxyphenylboronic acid?

The InChIKey is UYGMWHVMPASBMZ-UHFFFAOYSA-N.

What is the canonical SMILES of the compound?

The canonical SMILES is B(C1=C(C=CC(=C1Br)O)F)(O)O.

What is the molecular weight of 2-Bromo-6-fluoro-3-hydroxyphenylboronic acid?

The molecular weight is 234.82 g/mol.

How many hydrogen bond donor counts does the compound have?

The compound has 3 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does the compound have?

The compound has 4 hydrogen bond acceptor counts.

What is the topological polar surface area of 2-Bromo-6-fluoro-3-hydroxyphenylboronic acid?

The topological polar surface area is 60.7Ų.

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