[3,5-Bis(trifluoromethyl)phenyl]boronic acid

Basic Information

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CAS Number

73852-19-4

Molecular Formula

C8H5BF6O2

Molecular Weight

257.93 g/mol

Chemical Classification

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

217-220 °C

Boiling Point

128.685°C at 760 mmHg

Density

1.128

Flash Point

64.281℃

Refractive Index

1.378

SMILES

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

InChI

InChI=1S/C8H5BF6O2/c10-7(11,12)4-1-5(8(13,14)15)3-6(2-4)9(16)17/h1-3,16-17H

InChIKey

BPTABBGLHGBJQR-UHFFFAOYSA-N

LogP

1.4040000000000001

Topological Polar Surface Area

40.46 Å²

Hydrogen Bond Donor/Acceptor

2 / 2

Complexity

242

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

73852-19-4
3,5-BIS(TRIFLUOROMETHYL)PHENYLBOROIC ACID
FT-0614453
[3,5-bis(trifluoromethyl)phenyl]boronic acid
(3,5-Bis(trifluoromethyl)phenyl)boronicacid
3,5-BIS(TRIFLUOROMETHYL)-PHENYLBORONIC ACID
J-511239
3,5-Bis-trifluoromethylphenylboronic acid
3,5-bis-(trifluoromethyl)phenyl boronic acid
EN300-3230935
3,5-Bis(trifluoromethyl)benzeneboronic Acid
AM20060347
SCHEMBL126169
3,5-Bis(trifluoromethyl)phenylboronic acid
DTXSID00224421
3,5-bis(trifluoromethyl)phenyl boronic acid
CHEMBL280087
SY014949
AB02148
[3,5-Bis(Trifluoromethyl)Phenyl]Boranediol
Btfpba
3,5-DI(TRIFLUOROMETHYL)BENZENEBORONIC ACID
3,5-DI(TRIFLUOROMETHYL)PHENYLBORONIC ACID
3,5-di(trifluoromethyl)-phenylboronic acid
3,5-bis (trifluoromethyl)phenyl boronic acid
AKOS000285053
3,5-bis(trifluoromethyl)benzene boronic acid
MFCD00051850
3,5-bis-(trifluoromethyl)phenylboronic acid
(3,5-Bis(trifluoromethyl)phenyl)boronic acid
CS-W007417

MDL Number

MFCD00051850

Customs Code

2931900090

FAQ

What is [3,5-Bis(trifluoromethyl)phenyl]boronic acid (CAS: 73852-19-4)?

[3,5-Bis(trifluoromethyl)phenyl]boronic acid (CAS: 73852-19-4) is a boronic acid derivative with a phenyl ring substituted by two trifluoromethyl groups. Its chemical formula is C8H7BF3O2, and it appears as a white crystalline solid. The compound exhibits moderate solubility in organic solvents and is commonly used in organic synthesis due to its reactivity and functional group versatility. Its trifluoromethyl substituents enhance stability and provide unique chemical properties for applications in pharmaceutical and industrial chemistry.

What are the main uses of [3,5-Bis(trifluoromethyl)phenyl]boronic acid (CAS: 73852-19-4)?

[3,5-Bis(trifluoromethyl)phenyl]boronic acid (CAS: 73852-19-4) is primarily used in pharmaceuticals as a key intermediate in drug development, particularly for molecules requiring fluorinated functionality. It also serves in organic synthesis for Suzuki coupling reactions and other cross-coupling processes. Industrial applications include the production of specialty chemicals, while researchers utilize it in the creation of novel materials and functional compounds. Its unique structure makes it valuable in developing anti-cancer and anti-inflammatory agents.

Is [3,5-Bis(trifluoromethyl)phenyl]boronic acid (CAS: 73852-19-4) safe?

[3,5-Bis(trifluoromethyl)phenyl]boronic acid (CAS: 73852-19-4) is generally considered safe when handled properly. However, it may pose mild toxicity if ingested or inhaled, so standard safety precautions are recommended. Protective measures include wearing gloves, goggles, and a lab coat to avoid skin and respiratory contact. While not classified as highly hazardous, it should comply with OSHA and REACH regulations for chemical handling. Always follow lab safety guidelines to ensure safe use and disposal.

How should [3,5-Bis(trifluoromethyl)phenyl]boronic acid (CAS: 73852-19-4) be stored?

[3,5-Bis(trifluoromethyl)phenyl]boronic acid (CAS: 73852-19-4) should be stored in a dry, cool place (ideally 2-8°C) away from moisture and light. Keep it in a sealed, airtight container made of glass or HDPE to maintain stability and prevent degradation. Avoid exposure to incompatible substances and store in a well-ventilated area. Proper storage ensures its chemical integrity and extends shelf life for industrial and research applications.