3-Formylphenylboronic acid
Product Information
Molecular Formula
C7H7BO3
Molecular Weight
149.94
Description
Reagent used: To study the effects of boronic acid on fluoride-selective chemosignaling behavior of merocyanine dye; As exciton-coupled CD probes for epigallocatechin gallateBiological inhibitor of γ-glutamyltranspeptidase. Reactant involved in: Palladium-catalyzed homocoupling; Suzuki coupling reactions.
Synonyms
(3-formylphenyl)boronic acid
IUPAC Name
(3-formylphenyl)boronic acid
SMILES
B(C1=CC(=CC=C1)C=O)(O)O
InChI
InChI=1S/C7H7BO3/c9-5-6-2-1-3-7(4-6)8(10)11/h1-5,10-11H
InChI Key
HJBGZJMKTOMQRR-UHFFFAOYSA-N
Boiling Point
354.388 °C at 760 mmHg
Melting Point
109-113 °C
Flash Point
Not applicable
Purity
98 %
Density
1.244 g/cm3
LogP
-0.82110
Safety Information
Hazards
H314
Precautionary Statement
P260, P261, P264, P271, P280, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501
Signal Word
Danger
Computed Properties
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
2
Exact Mass
150.0488242 g/mol
Monoisotopic Mass
150.0488242 g/mol
Topological Polar Surface Area
57.5Ų
Heavy Atom Count
11
Formal Charge
0
Complexity
138
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-113788790-A | Aromatic heterocyclic amide derivative and application thereof | 2021-10-18 |
| CN-113620965-A | Nano organic cage with double-phase strong fluorescence and circular polarization luminescence and preparation method thereof | 2021-07-01 |
| CN-112851671-A | 4-substituted pyrido [2,3-d ] pyrimidine-7-ketone compound and preparation method and application thereof | 2021-02-08 |
| CN-112939971-A | Coumarin compound and preparation method and application thereof | 2021-02-08 |
| CN-112932412-A | Self-adhesion electronic skin based on multiple reversible bonding effects and preparation method and application thereof | 2021-01-20 |
| CN-112675823-A | Glycoprotein molecularly imprinted nanoparticles and synthetic method thereof | 2020-11-29 |
| CN-113968856-A | Compounds with kinase inhibition activity | 2020-07-23 |
| WO-2022017338-A1 | Tetrahydropyrazolo-pyrazinyl-dihydroimidazolone or tetrahydropyrazolo-pyridinyl-dihydroimidazolone compounds and methods of using same | 2020-07-20 |
| WO-2021169963-A1 | Aromatic compound and use thereof in preparing antineoplastic drugs | 2020-02-24 |
| WO-2021147953-A1 | Pyrimido five-membered ring derivative and application thereof | 2020-01-21 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 21378917 | 2009-09-01 | Metal-free carbon-carbon bond-forming reductive coupling between boronic acids and tosylhydrazones | Nature chemistry |
| 15131387 | 2004-05-01 | 3-formylphenylboronic acid | Acta crystallographica. Section C, Crystal structure communications |
