(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
Canonical 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)
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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