4-Aminophenylboronic Acid Pinacol Ester
Product Information
Molecular Formula
C12H18NO2B
Molecular Weight
219.09
Description
Reagent used for: Suzuki-Miyaura cross-coupling reactions ; Mercury(II) detection by fluorometry with new fluorogenic indicators based on through-bond energy transfer from pentaquinone to rhodamine ; Rhodium-catalyzed amination reactions ; Palladium-catalyzed Suzuki cross-coupling to synthesize potential antitubercular and antimicrobial compounds Reagent used in Preparation of ; Hexaphenylbenzene derivatives as a potential bioprobe and multichannel keypad system; Pyromellitic diimide-based polymer as matrix for solution-processable n-channel field-effect transistors ; Alternating copolymers of oligoarylenes and naphthalene bisimides as low band gap semiconductors with electrochemical and spectroelectrochemical behavior ; γ-secretase modulators in the treatment of Amyloid β formation.
Synonyms
4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline; 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline
IUPAC Name
4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)N
InChI
InChI=1S/C12H18BNO2/c1-11(2)12(3,4)16-13(15-11)9-5-7-10(14)8-6-9/h5-8H,14H2,1-4H3
InChI Key
ZANPJXNYBVVNSD-UHFFFAOYSA-N
Boiling Point
340 °C at 760 mmHg
Melting Point
165-169 °C (lit.)
Purity
97 %
Density
1.05 g/cm3
LogP
2.14920
Safety Information
Hazards
H315 - H319 - H335
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
Computed Properties
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
1
Exact Mass
219.1430590 g/mol
Monoisotopic Mass
219.1430590 g/mol
Topological Polar Surface Area
44.5Ų
Heavy Atom Count
16
Formal Charge
0
Complexity
244
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-113929635-A | 1, 6-diphenyl-1H-benzo [ d ] [1,2,3] triazole compound and preparation method and application thereof | 2021-11-09 |
| CN-113663733-A | Preparation and application of graphene covalent load bipyridine metal complex catalyst | 2021-09-15 |
| CN-113851599-A | Organic electroluminescent device and display device comprising same | 2021-09-13 |
| CN-113823750-A | Organic electroluminescent device and display device comprising same | 2021-08-10 |
| CN-113443999-A | Benzene liquid crystal compound and preparation method thereof | 2021-08-02 |
| CN-113387817-A | Fluorine-containing aromatic diamine compound, preparation method thereof and colorless transparent polyimide film | 2021-07-27 |
| CN-113045559-A | Diaryl urea PI3K alpha/mTOR double-target inhibitor and pharmaceutical composition and application thereof | 2021-03-15 |
| CN-112939964-A | Benzo-heterocycle substituted phenanthridine quaternary ammonium salt derivative and preparation method and application thereof | 2021-03-09 |
| CN-112898568-A | Conjugated microporous polymer based on 1,3,6, 8-tetra (4-aminophenyl) pyrene and preparation method thereof | 2021-02-06 |
| CN-113045582-A | PARP-1/PI3K double-target inhibitor or pharmaceutically acceptable salt thereof, and preparation method and application thereof | 2021-02-05 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 21336331 | 2011-03-01 | Palladium-mediated intracellular chemistry | Nature chemistry |
| 17922005 | 2007-11-01 | ATP-competitive inhibitors of the mitotic kinesin KSP that function via an allosteric mechanism | Nature chemical biology |
