6-Bromopyridine-3-boronic Acid - CAS 223463-14-7
Catalog: |
BB017539 |
Product Name: |
6-Bromopyridine-3-boronic Acid |
CAS: |
223463-14-7 |
Synonyms: |
(6-bromo-3-pyridinyl)boronic acid; (6-bromopyridin-3-yl)boronic acid |
IUPAC Name: | (6-bromopyridin-3-yl)boronic acid |
Description: | Reactant involved in: Iterative cross-coupling reactions for synthesis of non-cytotoxic terpyridines; The Garlanding approach for synthesis of phenyl-pyridyl scaffolds; Cyanation for synthesis of aromatic nitriles; Suzuki-Miyaura cross-coupling with dihalopyridines and dihalobipyridines; Petasis boronic Mannich reaction. |
Molecular Weight: | 201.81 |
Molecular Formula: | C5H5BrNO2B |
Canonical SMILES: | B(C1=CN=C(C=C1)Br)(O)O |
InChI: | InChI=1S/C5H5BBrNO2/c7-5-2-1-4(3-8-5)6(9)10/h1-3,9-10H |
InChI Key: | BCYWDUVHAPHGIP-UHFFFAOYSA-N |
Boiling Point: | 358.2 °C at 760 mmHg |
Melting Point: | 161-166 °C |
Flash Point: | Not applicable |
Purity: | ≥ 95 % |
Density: | 1.78 g/cm3 |
Storage: | 2-8 °C |
MDL: | MFCD03411558 |
LogP: | -0.47610 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
KR-20210023952-A | Compounds comprising benzophenone group, Organic electronic device comprising organic layers comprising the photo-cured of the monomer compounds | 20210224 |
CN-112125827-A | Synthetic method for derivatization reagent of steroid compound containing carbonyl | 20200930 |
WO-2021110614-A1 | HYDROPYRIDO[1,2-α]PYRAZINE COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASE | 20191203 |
US-2021106588-A1 | Bicyclic heterocycles as fgfr inhibitors | 20191014 |
WO-2021076602-A1 | Bicyclic heterocycles as fgfr inhibitors | 20191014 |
PMID | Publication Date | Title | Journal |
22967574 | 20120915 | A new derivatization approach for the rapid and sensitive analysis of brassinosteroids by using ultra high performance liquid chromatography-electrospray ionization triple quadrupole mass spectrometry | Talanta |
22272238 | 20120101 | Non inflammatory boronate based glucose-responsive insulin delivery systems | PloS one |
19111668 | 20090315 | An approach based on liquid chromatography/electrospray ionization-mass spectrometry to detect diol metabolites as biomarkers of exposure to styrene and 1,3-butadiene | Analytical biochemistry |
12711779 | 20030301 | 2-(6-bromopyridin-3-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane and (6-bromopyridin-3-yl)boronic acid, new bifunctional building blocks for combinatorial chemistry | Acta crystallographica. Section C, Crystal structure communications |
12375993 | 20021018 | Functionalized pyridylboronic acids and their Suzuki cross-coupling reactions to yield novel heteroarylpyridines | The Journal of organic chemistry |
Complexity: | 114 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 200.95967 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 200.95967 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 53.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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