6-Bromohexylboronic acid

Product Information

Molecular Formula:
C6H14BBrO2
Molecular Weight:
208.9
Description
6-Bromohexylboronic acid is a crucial compound in biomedicine used for the treatment of various diseases. It acts as a reagent in drug synthesis, primarily targeting cancerous cells. With its boronic acid moiety, it exhibits potential as a proteasome inhibitor, greatly impacting the treatment of multiple myeloma and other cancers. Its efficient synthesis and excellent compatibility make it an essential tool for drug discovery and development in the biomedical industry.
Synonyms
6-bromohexylboronicacid; 6-BROMOHEXYLBORONICACID; 148562-12-3; (6-Bromohexyl)boronicacid; 6-Bromohexylboronicacid; ACMC-209d0w
IUPAC Name
6-bromohexylboronic acid
Canonical SMILES
B(CCCCCCBr)(O)O
InChI
InChI=1S/C6H14BBrO2/c8-6-4-2-1-3-5-7(9)10/h9-10H,1-6H2
InChI Key
BGHGWFMYADQHHC-UHFFFAOYSA-N
Melting Point
78-83°C
Flash Point
Not applicable
Purity
95%
Appearance
White to tan solid, powder, crystals, flakes, crystalline powder and/or chunks
Storage
2-8°C

Computed Properties

Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
6
Exact Mass
208.02702 g/mol
Monoisotopic Mass
208.02702 g/mol
Topological Polar Surface Area
40.5Ų
Heavy Atom Count
10
Formal Charge
0
Complexity
70.8
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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