5-Bromo-2-hydroxyphenylboronic acid

• CAS: 89598-97-0
• Catalog Number: ACM89598970
• Category: Boronic Acids
• Molecular Weight: 216.83
• Molecular Formula: C₆H₆BBrO₃
• Synonyms: 5-Bromo-2-hydroxyphenylboronic acid, 89598-97-0, 2-Borono-4-bromophenol, (5-Bromo-2-hydroxyphenyl)boronic acid, ACMC-209r1x, SureCN3610834, AC1Q714D, CTK5G3300, MolPort-001-760-875, (5-bromo-2-hydroxyphenyl)boranediol, 5-Bromo-2-hydroxybenzeneboronic acid, ANW-39331, OR1920, AKOS015834775, AB03340, AG-H-62521, AK-91628, BP-11307, KB-42079, 5-Bromo-2-hydroxybenzeneboronic acid 97%
• IUPAC Name: (5-bromo-2-hydroxyphenyl)boronic acid
• SMILES: B(C1=C(C=CC(=C1)Br)O)(O)O
• InChI Key: XSXTWLOHAGPBNO-UHFFFAOYSA-N
• Boiling Point: 378.3ºC at 760 mmHg
• Melting Point: 196-200ºC
• Flash Point: 182.6ºC
• Density: 1.84g/cm³
• Exact Mass: 215.95900
• Hazard Statements: Xi: Irritant
• H-Bond Acceptor: 3
• H-Bond Donor: 3

Custom Q&A

What is the molecular formula of 5-Bromo-2-hydroxyphenylboronic acid?

The molecular formula is C6H6BBrO3.

What is the IUPAC name of 5-Bromo-2-hydroxyphenylboronic acid?

The IUPAC name is (5-bromo-2-hydroxyphenyl)boronic acid.

What is the InChI of 5-Bromo-2-hydroxyphenylboronic acid?

The InChI is InChI=1S/C6H6BBrO3/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3,9-11H.

What is the InChIKey of 5-Bromo-2-hydroxyphenylboronic acid?

The InChIKey is XSXTWLOHAGPBNO-UHFFFAOYSA-N.

What is the canonical SMILES of 5-Bromo-2-hydroxyphenylboronic acid?

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

What is the CAS number of 5-Bromo-2-hydroxyphenylboronic acid?

The CAS number is 89598-97-0.

What is the molecular weight of 5-Bromo-2-hydroxyphenylboronic acid?

The molecular weight is 216.83 g/mol.

How many hydrogen bond donor counts are there in 5-Bromo-2-hydroxyphenylboronic acid?

There are 3 hydrogen bond donor counts.

How many hydrogen bond acceptor counts are there in 5-Bromo-2-hydroxyphenylboronic acid?

There are 3 hydrogen bond acceptor counts.

How many rotatable bond counts are there in 5-Bromo-2-hydroxyphenylboronic acid?

There is 1 rotatable bond count.