9-Phenanthrylboronic acid

Basic Information

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CAS Number

68572-87-2

Molecular Formula

C14H11BO2

Molecular Weight

222.05 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Melting Point

165-170 °C

Boiling Point

479.5℃ at 760 mmHg

Flash Point

243.796℃

Solubility

Soluble in DMSO.

SMILES

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B(C1=CC2=CC=CC=C2C3=CC=CC=C13)(O)O

InChI

InChI=1S/C14H11BO2/c16-15(17)14-9-10-5-1-2-6-11(10)12-7-3-4-8-13(12)14/h1-9,16-17H

InChIKey

JCDAUYWOHOLVMH-UHFFFAOYSA-N

LogP

1.6727999999999996

Topological Polar Surface Area

40.46 Å²

Hydrogen Bond Donor/Acceptor

2 / 2

Complexity

269

Safety Information

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GHS Hazard Pictograms

H315

H319

H335

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

SCHEMBL368234
Phenanthrene-9-boronic acid
DTXSID80472347
AM20060975
9-phenanthrenylboronic acid
BDBM50067909
CHEMBL140467
FT-0641194
MFCD00143524
AB03875
9-Phenanthracenylboronic acid
68572-87-2
PHENANTHRACENE-9-BORONIC ACID
9-Phenanthreneboronicacid
9-phenanthrene boronic acid
J-519520
SY014923
(phenanthren-9-yl)boronic acid
P1093
AKOS008901242
9-Phenanthreneboronic Acid
9-BAPA
BCP9000204
BCP22764
9-Phenanthreneboronic Acid (contains varying amounts of Anhydride)
Boronic acid, 9-phenanthrenyl-
AS-15952
A836187
EN300-7383692
JCDAUYWOHOLVMH-UHFFFAOYSA-N
CS-W002428

MDL Number

MFCD00143524

Customs Code

2931900090

FAQ

What is 9-Phenanthrylboronic acid (CAS: 68572-87-2)?

9-Phenanthrylboronic acid (CAS: 68572-87-2) is a boronic acid derivative with the chemical formula C14H10B2O3. It is a white solid with low solubility in water and is commonly used in organic synthesis. The compound features a phenanthrene ring system attached to a boronic acid group, making it valuable for functional group transformations and pharmaceutical applications.

What are the main uses of 9-Phenanthrylboronic acid (CAS: 68572-87-2)?

9-Phenanthrylboronic acid (CAS: 68572-87-2) is primarily used in pharmaceutical research for drug development, particularly in Suzuki coupling reactions. It serves as a building block for creating complex molecules in organic synthesis. Applications also include materials science and as an intermediate in the production of specialty chemicals. Its unique structure makes it relevant in targeting biological pathways.

Is 9-Phenanthrylboronic acid (CAS: 68572-87-2) safe?

9-Phenanthrylboronic acid (CAS: 68572-87-2) is generally considered safe when handled properly. However, it may cause mild skin or eye irritation. Safety precautions include wearing gloves, safety goggles, and a lab coat. It should be stored in a well-ventilated area, and exposure should be minimized. Always follow standard chemical safety protocols for handling boronic acid derivatives.

How should 9-Phenanthrylboronic acid (CAS: 68572-87-2) be stored?

9-Phenanthrylboronic acid (CAS: 68572-87-2) should be stored in a cool, dry place below 25°C, away from light. Keep it in a sealed container to prevent moisture absorption and degradation. Maintain low humidity to ensure stability, and avoid exposure to air or reactive substances. Store in a chemical storage cabinet for safety and longevity.