2,6-Dimethylphenylboronic Acid
Product Information
Molecular Formula
C8H11O2B
Molecular Weight
149.98
Description
Reagent used for: Palladium catalyzed Suzuki-Miyaura coupling reactions ; One-pot ipso-nitration of arylboronic acids including broader substrate scope of heterocycles and functional groups ; Nickel-Catalyzed Cross-Coupling of Chromene Acetals and Boronic Acids ; Visible-light initiated aerobic oxidative hydroxylation catalyzed by Ru-complex ; Rhodium(I)-catalyzed 1,4-addition reactions ; Pd-catalyzed homocouplings ; Expanded scope of Cu assisted Suzuki-Miyaura coupling reactions including aryl chlorides and polyhalo aryl boronates Reagent used in Prepration of; Orally bioavialable G Protein-Coupled Receptor 40 agonists for diabetes treatment ; Solid phase synthesis and antitumor structure-activity relationship of Smac triazoloprolines and biarylalanines tetrapeptide libraries ; Protein Kinase inhibitors.
Synonyms
(2,6-dimethylphenyl)boronic acid; (2,6-dimethylphenyl)boronic acid
IUPAC Name
(2,6-dimethylphenyl)boronic acid
SMILES
B(C1=C(C=CC=C1C)C)(O)O
InChI
InChI=1S/C8H11BO2/c1-6-4-3-5-7(2)8(6)9(10)11/h3-5,10-11H,1-2H3
InChI Key
ZXDTWWZIHJEZOG-UHFFFAOYSA-N
Boiling Point
299.9 °C at 760 mmHg
Melting Point
105 °C (dec.) (lit.)
Flash Point
Not applicable
Purity
≥ 95.0 %
Density
1.07 g/cm3
Appearance
Crystalline powder
Storage
Keep in dark place, Sealed in dry, Room Temperature
LogP
-0.01680
Safety Information
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
2
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
1
Exact Mass
150.0852098 g/mol
Monoisotopic Mass
150.0852098 g/mol
Topological Polar Surface Area
40.5Ų
Heavy Atom Count
11
Formal Charge
0
Complexity
117
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-111960987-A | Synthesis method of methylene bis (isoindole) compound | 2020-08-11 |
| CN-111960987-B | Synthesis method of methylene bis (isoindole) compound | 2020-08-11 |
| CN-114057798-A | Organic electroluminescent material and device | 2020-07-30 |
| KR-20220015348-A | Organic electroluminescent materials and devices | 2020-07-30 |
| US-2022041637-A1 | Organic electroluminescent materials and devices | 2020-07-30 |
| WO-2022012456-A1 | Novel heterocyclic compounds as bet inhibitors | 2020-07-17 |
| WO-2022013408-A2 | Cyclic cyanoenone derivatives as modulators of keap1 | 2020-07-16 |
| JP-2022022902-A | Compound with fluorene skeleton | 2020-07-10 |
| KR-20210152245-A | Organometallic compound and organic light emitting device including the same | 2020-06-08 |
| US-2021380620-A1 | Organometallic compound and organic light-emitting device including the same | 2020-06-08 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 20201431 | 2009-10-01 | Improvement on synthesis of different alkyl-phenylboronic acid | Journal of biomedical nanotechnology |
| 12160390 | 2002-08-12 | Tetraarylpentaborates, [B(5)O(6)Ar(4)](-) (Ar = C(6)H(4)OMe-4, C(6)H(3)Me(2)-2,6): their formation from the reaction of arylboronic acids with an aryloxorhodium complex, structure, and chemical properties | Inorganic chemistry |
| 3869 | 1976-02-01 | Dynamics of the changes in the tissular levels of cyclic AMP after cobalt-60 gamma-irradiation | Strahlentherapie |
| 4893 | 1975-11-01 | Clinical experience with beta-blockers in consultant psychiatric practice | Scottish medical journal |
