(anthracen-9-yl)boronic acid
Product Information
Molecular Formula
C14H11BO2
Molecular Weight
222.047
Description
(Anthracen-9-yl)boronic acid is a chemical compound often used in medical research for drug development. It plays a pivotal role in Suzuki-Miyaura cross-coupling reactions, enabling the synthesis of bioactive molecules employed in anticancer drug studies.
Synonyms
9-Anthracenylboronic acid,9-Anthrylboronic acid
IUPAC Name
anthracen-9-ylboronic acid
SMILES
B(C1=C2C=CC=CC2=CC3=CC=CC=C13)(O)O
InChI
InChI=1S/C14H11BO2/c16-15(17)14-12-7-3-1-5-10(12)9-11-6-2-4-8-13(11)14/h1-9,16-17H
InChI Key
VHHDLIWHHXBLBK-UHFFFAOYSA-N
Melting Point
203-250 °C
Flash Point
Not applicable
Purity
99%
Density
1.26 ± 0.1g/mL (predicted)
Appearance
White powder
Safety Information
Hazards
H301
Precautionary Statement
P301 + P310
Computed Properties
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
1
Exact Mass
222.0852098 g/mol
Monoisotopic Mass
222.0852098 g/mol
Topological Polar Surface Area
40.5Ų
Heavy Atom Count
17
Formal Charge
0
Complexity
247
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-113956181-A | Para-cyanoethylene derivative, para-cyanoethylene derivative crystal, preparation method and application | 2021-10-29 |
| CN-113831237-A | Synthesis method of 9-anthracenecarboxylic acid | 2021-08-02 |
| CN-113460997-A | Preparation method of three-dimensional grid-shaped graphene material | 2021-06-01 |
| CN-113264911-A | Compound, organic light-emitting material and organic electroluminescent device | 2021-04-30 |
| CN-112920221-A | Chiral phosphoric acid with spiro-bis-dihydrobenzothiole skeleton and preparation method and application thereof | 2021-01-26 |
| CN-112778376-A | Metallocene compound and application thereof | 2021-01-21 |
| CN-112645791-A | Novel OLED material and preparation method and application thereof | 2020-12-22 |
| CN-112094285-A | Boron-nitrogen doped polycyclic conjugated aromatic hydrocarbon embedded with pyrrole unit and synthetic method thereof | 2020-09-28 |
| WO-2022045825-A1 | Method for preparing deuterated aromatic compound and deuterated composition | 2020-08-27 |
| WO-2022008732-A1 | Enhancing the activity of antimicrobial preservatives | 2020-07-10 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 18219900 | 2007-11-01 | [A case of advanced breast cancer successfully treated with multi-disciplinary therapy and S-1 administration] | Gan to kagaku ryoho. Cancer & chemotherapy |
| 16927350 | 2006-11-15 | The multichromophore approach: prolonged room-temperature luminescence lifetimes in Ru(II) complexes based on tridentate polypyridine ligands | Chemistry (Weinheim an der Bergstrasse, Germany) |
