(3-Aminophenyl)boronic acid hydrochloride (1:1)

Basic Information

View in Editor

CAS Number

85006-23-1

Molecular Formula

C6H9BClNO2

Molecular Weight

173.41 g/mol

Basic Physical Properties

Melting Point

>300℃

Boiling Point

376 °C at 760 mmHg

Flash Point

376 °C at 760 mmHg

SMILES

View in Editor

OB(C1=CC=CC(N)=C1)O.[H]Cl

InChI

InChI=1S/C6H8BNO2.ClH/c8-6-3-1-2-5(4-6)7(9)10;/h1-4,9-10H,8H2;1H

InChIKey

QBMHZZHJIBUPOX-UHFFFAOYSA-N

LogP

-0.6295999999999999

Topological Polar Surface Area

66.48 Å²

Hydrogen Bond Donor/Acceptor

4 / 3

Complexity

110

Safety Information

View Safety Information

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

(3-Aminophenyl)boronic acid hydrochloride
3-Aminophenylboronic acid hydrochloride
3-Aminobenzeneboronic acid hydrochloride
3-Aminophenylboronic acid, HCl
(m-Aminophenyl)boronic acid hydrochloride
(3-aminophenyl)boronic acid;hydrochloride

MDL Number

MFCD00191748

Customs Code

29310095

FAQ

What is (3-Aminophenyl)boronic acid hydrochloride (CAS: 85006-23-1)?

(3-Aminophenyl)boronic acid hydrochloride (CAS: 85006-23-1) is a white to off-white powder used in chemical synthesis and as an intermediate in pharmaceutical and biotech industries. It has a chemical formula of C9H9NO4•HCl and is known for its ability to participate in Suzuki coupling reactions.

What are the main uses of (3-Aminophenyl)boronic acid hydrochloride (CAS: 85006-23-1)?

(3-Aminophenyl)boronic acid hydrochloride (CAS: 85006-23-1) is primarily used as a key reagent in organic synthesis, particularly in cross-coupling reactions such as Suzuki coupling for the synthesis of complex molecules. It is also used in the development of new drugs and as a research tool in biochemistry and materials science.

Is (3-Aminophenyl)boronic acid hydrochloride (CAS: 85006-23-1) safe?

(3-Aminophenyl)boronic acid hydrochloride (CAS: 85006-23-1) is generally considered safe when handled with standard laboratory precautions. However, it should be stored away from heat and direct sunlight, and proper ventilation should be maintained. Protective gloves and eyewear are recommended during handling.

How should (3-Aminophenyl)boronic acid hydrochloride (CAS: 85006-23-1) be stored?

(3-Aminophenyl)boronic acid hydrochloride (CAS: 85006-23-1) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent moisture absorption. The storage area should have good ventilation to avoid the risk of inhalation exposure.