(6-Bromohexyl)boronic acid

Basic Information

View in Editor

CAS Number

148562-12-3

Molecular Formula

C6H14BBrO2

Molecular Weight

208.89 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Melting Point

78-83 °C

SMILES

View in Editor

B(CCCCCCBr)(O)O

InChI

InChI=1S/C6H14BBrO2/c8-6-4-2-1-3-5-7(9)10/h9-10H,1-6H2

InChIKey

BGHGWFMYADQHHC-UHFFFAOYSA-N

LogP

1.4144999999999999

Topological Polar Surface Area

40.46 Å²

Hydrogen Bond Donor/Acceptor

2 / 2

Complexity

70.8

Synonyms & References

English

6-Bromohexylboronic acid
148562-12-3
MS-21043
6-BROMOHEXYLBORONIC ACID
CS-0174975
DTXSID60674701
6-Bromohexylboronic acid, >=95%
A884348
(6-Bromohexyl)boronicacid
AKOS015836150
(6-Bromohexyl)boronic acid
Boronic acid, B-(6-bromohexyl)-
J-008485
MFCD10000908
6-Bromohexylboronic acid
Boronic acid,(6-bromohexyl)- (9CI)
6-Bromohexylboronic acid >=95%

MDL Number

MFCD10000908

Customs Code

2931900090

FAQ

What are the physical and chemical properties of (6-Bromohexyl)boronic acid (CAS: 148562-12-3)?

(6-Bromohexyl)boronic acid (CAS: 148562-12-3) is a crystalline solid with a molecular weight of approximately 268.03 g/mol. It is slightly soluble in water but soluble in organic solvents like ethanol and acetone. Chemically, it is highly reactive towards nucleophiles, particularly in esterification and other condensation reactions.

How is (6-Bromohexyl)boronic acid (CAS: 148562-12-3) typically synthesized?

(6-Bromohexyl)boronic acid is typically synthesized by reacting 1-bromohexane with boronic anion sources like tributyltin borate in the presence of a base such as potassium tert-butoxide. The reaction yields a high selectivity and moderate to good yield, depending on the conditions.

What industries use (6-Bromohexyl)boronic acid (CAS: 148562-12-3)?

(6-Bromohexyl)boronic acid (CAS: 148562-12-3) is used in pharmaceuticals for the synthesis of certain drug molecules, in polymer science for the preparation of functional polymers, and in sensor technology for developing chemical sensors due to its reactivity and stability.

What precautions should be taken when handling (6-Bromohexyl)boronic acid (CAS: 148562-12-3)?

When handling (6-Bromohexyl)boronic acid, wear appropriate personal protective equipment (PPE), including gloves and safety goggles. Store in a cool, dry place away from heat sources. Use a fume hood during handling to minimize exposure. In case of spill, contain the spill, clean up according to standard procedures, and consult the Safety Data Sheet (SDS) for detailed information.