2-Hydroxyphenylboronic Acid
Product Information
Molecular Formula
C6H7O3B
Molecular Weight
137.93
Description
2-Hydroxyphenylboronic Acid (CAS# 89466-08-0) is a useful research chemical.
Synonyms
(2-hydroxyphenyl)boronic acid; (2-hydroxyphenyl)boronic acid
IUPAC Name
(2-hydroxyphenyl)boronic acid
SMILES
B(C1=CC=CC=C1O)(O)O
InChI
InChI=1S/C6H7BO3/c8-6-4-2-1-3-5(6)7(9)10/h1-4,8-10H
InChI Key
YDMRDHQUQIVWBE-UHFFFAOYSA-N
Boiling Point
327.3 °C at 760 mmHg
Flash Point
Not applicable
Purity
99 %
Density
1.32 ± 0.1 g/mL
Appearance
White powder
LogP
-0.92800
Safety Information
Hazards
H302 - H318
Precautionary Statement
P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word
Warning
Computed Properties
Hydrogen Bond Donor Count
3
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
1
Exact Mass
138.0488242 g/mol
Monoisotopic Mass
138.0488242 g/mol
Topological Polar Surface Area
60.7Ų
Heavy Atom Count
10
Formal Charge
0
Complexity
107
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-113880859-A | 2-aryl-4-arylmethylamino pyrimidine compound and application thereof | 2021-11-16 |
| CN-113583467-A | Nucleic acid fluorescent dye and preparation and application thereof | 2021-08-20 |
| CN-113444038-A | 2-aryl isonicotinic acid amide LSD1/HDAC double-target inhibitor, and preparation method and application thereof | 2021-07-07 |
| CN-113527195-A | 5-aryl nicotinamide LSD1/HDAC double-target inhibitor, preparation method and application thereof | 2021-07-07 |
| CN-113234106-A | Four-tooth ring metal complex and organic light-emitting device | 2021-06-04 |
| CN-113264911-A | Compound, organic light-emitting material and organic electroluminescent device | 2021-04-30 |
| CN-113058646-A | Heterogeneous hindered Lewis acid-base pair catalyst and preparation method and application thereof | 2021-03-26 |
| CN-112341470-A | Electron transport material, organic electroluminescent device and display device | 2020-09-29 |
| CN-111943971-A | Preparation method of boric acid derivative | 2020-09-17 |
| CN-112047970-A | Method for preparing boric acid derivative | 2020-09-17 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 22250781 | 2012-03-08 | Identification of novel adenosine A(2A) receptor antagonists by virtual screening | Journal of medicinal chemistry |
