Boron trifluoride phenol complex

Basic Information

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CAS Number

462-05-5

Molecular Formula

C12H12BF3O2

Molecular Weight

256.03 g/mol

Chemical Classification

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Boiling Point

178 °C

SMILES

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

InChI

InChI=1S/2C6H6O.BF3/c2*7-6-4-2-1-3-5-6;2-1(3)4/h2*1-5,7H;

InChIKey

OQORKFSQJPQHSZ-UHFFFAOYSA-N

LogP

3.6642000000000023

Topological Polar Surface Area

40.46 Å²

Hydrogen Bond Donor/Acceptor

2 / 2

Complexity

54.1

Safety Information

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Hazard Statement

H226 Flammable liquid and vapor
Flammable liquids

H314 Causes severe skin burns and eye damage
Skin corrosion/irritation

Synonyms & References

English

DTXSID20583704
Phenol--trifluoroborane (2/1)
462-05-5
boron trifluoride-phenol complex (1:2)
BORON TRIFLUORIDE PHENOL COMPLEX
Boron trifluoride phenol complex compound
Phenol, reaction products with boron trifluoride
phenol,trifluoroborane
434299_ALDRICH
Boron trifluoride phenol complex (1:2)

FAQ

What regulatory guidelines apply to Boron trifluoride phenol complex (CAS: 462-05-5)?

Boron trifluoride phenol complex (CAS: 462-05-5) falls under the classification of a hazardous chemical under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS). It is regulated by REACH (Registration, Evaluation, Authorisation and Restriction of Chemicals) in the European Union, and by the EPA and FDA in the United States. Specific handling, storage, and transportation requirements must be adhered to, and Material Safety Data Sheets (MSDS) should be readily available for safety information.

Are there alternatives to Boron trifluoride phenol complex (CAS: 462-05-5) in synthesis?

There are several alternatives to Boron trifluoride phenol complex (CAS: 462-05-5) that can be used in synthesis, depending on the specific requirements of the reaction. Common alternatives include boron trifluoride etherate and boron trifluoride diethyl ether complex. These alternatives offer similar reactivity but may have different solubility and compatibility issues.

What is the market or research trend for Boron trifluoride phenol complex (CAS: 462-05-5)?

The market for Boron trifluoride phenol complex (CAS: 462-05-5) is primarily driven by its use in organic synthesis, particularly in the production of various pharmaceuticals and specialty chemicals. Research trends are focusing on its applications in green chemistry and sustainable processes. However, due to its hazardous nature, there is a growing interest in developing safer alternatives and more environmentally friendly complexes.

How should waste containing Boron trifluoride phenol complex (CAS: 462-05-5) be handled?

Waste containing Boron trifluoride phenol complex (CAS: 462-05-5) should be managed according to hazardous waste disposal regulations. Collect the waste in appropriate containers and label them clearly. Incineration is a common method, but it must be conducted in a controlled environment. For safer disposal, consult a professional waste management company that specializes in hazardous waste. Proper disposal is crucial to prevent environmental contamination and ensure worker safety.