(3-Chloro-5-methylphenyl)boronic acid

Basic Information

View in Editor

CAS Number

913836-14-3

Molecular Formula

C7H8BClO2

Molecular Weight

170.4 g/mol

Chemical Classification

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

235-238

Boiling Point

336.3°C at 760 mmHg

SMILES

View in Editor

B(C1=CC(=CC(=C1)Cl)C)(O)O

InChI

InChI=1S/C7H8BClO2/c1-5-2-6(8(10)11)4-7(9)3-5/h2-4,10-11H,1H3

InChIKey

QXHLBINWDJITMJ-UHFFFAOYSA-N

LogP

0.3282199999999998

Topological Polar Surface Area

40.46 Å²

Hydrogen Bond Donor/Acceptor

2 / 2

Complexity

132

Safety Information

View Safety Information

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

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

Synonyms & References

English

(3-Chloro-5-methylphenyl)boronic acid
3-Chloro-5-methylbenzeneboronic acid
3-CHLORO-5-METHYLPHENYLBORONIC ACID
Boronicacid, B-(3-chloro-5-methylphenyl)-
Boronic acid, (3-chloro-5-methylphenyl)-
FCH919639
OR3621
AB49144
SY031495
Boronicacid,b-(3-chloro-5-methylphenyl)-
AX8222894
AB0027537
W9381
ST24020389
B-(3-Chloro-5-methylphenyl)boronic acid (ACI)
Boronic acid, (3-chloro-5-methylphenyl)- (9CI)
(3-Methyl-5-chlorophenyl)boronic acid
3-Chloro-5-methylphenylboronic acid
(3-Chloro-5-methylphenyl)boronicacid
BP-11117
913836-14-3
Z1201624884
CS-W005723
DS-17371
SCHEMBL2317082
DTXSID20611157
AKOS006220918
EN300-7292715
MFCD09027241

MDL Number

MFCD09027241

Customs Code

2931900090

FAQ

What is (3-Chloro-5-methylphenyl)boronic acid (CAS: 913836-14-3)?

(3-Chloro-5-methylphenyl)boronic acid is a chemical compound with the CAS number 913836-14-3. It is an organic boronic acid derivative characterized by its aromatic ring structure, featuring a chloro and methyl substituent. This compound is commonly used in organic synthesis and as a reagent in various chemical reactions.

What are the main uses of (3-Chloro-5-methylphenyl)boronic acid (CAS: 913836-14-3)?

(3-Chloro-5-methylphenyl)boronic acid is widely used in pharmaceutical and chemical industries, particularly in organic synthesis. It serves as a key reagent in Suzuki coupling reactions and other palladium-catalyzed cross-coupling reactions, facilitating the formation of carbon-carbon bonds in complex organic molecules.

Is (3-Chloro-5-methylphenyl)boronic acid (CAS: 913836-14-3) safe?

(3-Chloro-5-methylphenyl)boronic acid (CAS: 913836-14-3) is generally considered safe when used and stored correctly. However, it should be handled with caution due to its chemical nature. Protective measures include wearing gloves, goggles, and a lab coat. Exposure to light and moisture should be minimized, and it should be stored in a dry, well-ventilated area away from direct sunlight and heat sources.

How should (3-Chloro-5-methylphenyl)boronic acid (CAS: 913836-14-3) be stored?

(3-Chloro-5-methylphenyl)boronic acid should be stored in a tightly closed container in a cool, dry place away from direct sunlight and sources of heat. The storage temperature should be maintained below 25°C, and the container should be protected from moisture to prevent degradation of the compound. Adequate ventilation is recommended to avoid the accumulation of potentially flammable gases during storage.