3,5-Dibromophenylboronic Acid
Product Information
Molecular Formula
C6H5Br2O2B
Molecular Weight
279.72
Description
Reactant involved in: Vacuo condensation and on-surface radical addition for synthesis of phenylene-boroxine networks; Lithiation of dihalophenyl dioxazaborocines yielding functionalized dihalophenylboronic acids; Cycloboronation of tetrasubstituted butanetetraols; Homocoupling of arylboronic acids; Synthesis of borondipyrromethene hybrids; Studies of structure and activity of NHC and dendritic NHC iridium complexes.
Synonyms
(3,5-dibromophenyl)boronic acid; (3,5-dibromophenyl)boronic acid
IUPAC Name
(3,5-dibromophenyl)boronic acid
SMILES
B(C1=CC(=CC(=C1)Br)Br)(O)O
InChI
InChI=1S/C6H5BBr2O2/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3,10-11H
InChI Key
WQBLCGDZYFKINX-UHFFFAOYSA-N
Boiling Point
382.8 °C at 760 mmHg
Melting Point
>300 °C (lit.)
Flash Point
Not applicable
Purity
≥ 95 %
Density
2.09 g/cm3
Appearance
Light pink powder
Storage
Keep in dark place, Sealed in dry, Room Temperature
LogP
0.89140
Safety Information
Precautionary Statement
P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501
Signal Word
Warning
Computed Properties
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
1
Exact Mass
279.87289 g/mol
Monoisotopic Mass
277.87493 g/mol
Topological Polar Surface Area
40.5Ų
Heavy Atom Count
11
Formal Charge
0
Complexity
124
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
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| CN-113788846-A | Tricyclic thiazolo [5,4-d ] pyrimidone derivative and application thereof | 2021-10-27 |
| CN-112852036-A | Aluminum alloy far infrared radiation material and knapsack | 2021-01-06 |
| CN-112898324-A | Compound, application thereof and organic electroluminescent device | 2019-12-03 |
| KR-20210039248-A | Benzimidazolone derivatives organic light emitting compound and organic electroluminescent device including the same | 2019-10-01 |
| CN-110283134-B | Triazine benzene derivative and application thereof | 2019-06-21 |
| US-2020399540-A1 | Brominated flame-retardant tetrazines | 2019-06-19 |
| US-11198818-B2 | Brominated flame-retardant tetrazines | 2019-06-19 |
| JP-2020169287-A | Compounds, precursors, electrolyte membranes, fuel cells, water electrolysis and electrolysis technology | 2019-04-04 |
| WO-2019148005-A1 | Inhibitors of cbl-b and methods of use thereof | 2018-01-26 |
| EP-3743063-A1 | Inhibitors of cbl-b and methods of use thereof | 2018-01-26 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 4891 | 1975-11-01 | Oxprenolol in senile tremor | Scottish medical journal |
