3-Aminophenylboronic Acid Monohydrate
Product Information
Molecular Formula
C6H10NO3B
Molecular Weight
154.96
Description
Reagent used for: Suzuki-Miyaura cross-coupling. Reagent used for Preparation of; Gram-positive antivirulence drugs and inhibitors of Streptococcus agalactiae Stk1; Regioisomer of Zaleplon (a sedative); Amphiphilic random glycopolymer, which self-assemble to form nanoparticles, with potential as a glucose-sensitive matrix ; Chemomechanical polymer that expands and contracts in blood plasma with high glucose selectivity.
Synonyms
(3-aminophenyl)boronic acid;hydrate; (3-aminophenyl)boronic acid;hydrate
IUPAC Name
(3-aminophenyl)boronic acid;hydrate
SMILES
B(C1=CC(=CC=C1)N)(O)O.O
InChI
InChI=1S/C6H8BNO2.H2O/c8-6-3-1-2-5(4-6)7(9)10;/h1-4,9-10H,8H2;1H2
InChI Key
XAEOVQODHLLNKX-UHFFFAOYSA-N
Boiling Point
376 °C at 760 mmHg
Melting Point
93-96 °C (lit.)
Flash Point
Not applicable
Purity
98 %
Density
1.23 g/cm3
LogP
-0.53450
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
4
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
1
Exact Mass
155.0753733 g/mol
Monoisotopic Mass
155.0753733 g/mol
Topological Polar Surface Area
67.5Ų
Heavy Atom Count
11
Formal Charge
0
Complexity
110
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
2
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| WO-2022053718-A1 | Method for labeling nucleic acid | 2020-09-14 |
| WO-2021243421-A1 | Dual kinase-bromodomain inhibitors | 2020-06-05 |
| WO-2021166900-A1 | Organic electroluminescent element, organic el display device, and organic el lighting | 2020-02-20 |
| TW-202136369-A | Organic electroluminescence element, organic EL display device and organic EL lighting | 2020-02-20 |
| WO-2021145429-A1 | Compound, material for organic electroluminescent elements, organic electroluminescent element, and electronic device | 2020-01-15 |
| WO-2021123229-A1 | Synthesis of lactone derivatives and their use in the modification of proteins | 2019-12-20 |
| WO-2021126989-A1 | Two-way magnetic resonance tuning nanoprobe enhanced subtraction imaging | 2019-12-17 |
| WO-2021125011-A1 | Polymer, composition for organic electroluminescent element, composition for forming hole transport layer or hole injection layer, organic electroluminescent element, organic el display device, and organic el illuminator | 2019-12-16 |
| TW-202132409-A | Polymer, composition for organic electroluminescence element, composition for forming hole transport layer or hole injection layer, organic electroluminescence element and its manufacturing method, organic EL display device and organic EL illumination | 2019-12-16 |
| CN-110105260-B | Aromatic ring ureido indole derivative and preparation method and application thereof | 2019-06-11 |
