3-Bromo-4-(trifluoromethoxy)phenol

Basic Information

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CAS Number

886496-88-4

Molecular Formula

C7H4BrF3O2

Molecular Weight

257.01 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

SMILES

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C1=CC(=C(C=C1O)Br)OC(F)(F)F

InChI

InChI=1S/C7H4BrF3O2/c8-5-3-4(12)1-2-6(5)13-7(9,10)11/h1-3,12H

InChIKey

GVPNWQKCKBFPBG-UHFFFAOYSA-N

LogP

3.053300000000001

Topological Polar Surface Area

29.46 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

174

Synonyms & References

English

SY024383
DTXSID40373765
SCHEMBL263399
EN300-125904
CL8476
AM62593
Z1269176252
3-bromo-4-trifluoromethoxyphenol
AC-30070
MFCD05864310
886496-88-4
FT-0645025
3-bromo-4-(trifluoromethoxy)phenol
A842800
AKOS015891408
PS-7397
3-Bromo-4-trifluoromethoxy-phenol
3-Bromo-4-(trifluoromethoxy)phenol
5-Hydroxy-2-(trifluoromethoxy)bromobenzene
3-bromo-4-tirfluoromethoxyphenol
PubChem2838
GVPNWQKCKBFPBG-UHFFFAOYSA-N
SBB101805
KM2696
Phenol,3-bromo-4-(trifluoromethoxy)-
AS00163
3-bromanyl-4-(trifluoromethyloxy)phenol
BC002343

MDL Number

MFCD05864310

Customs Code

2909500000

FAQ

What regulatory guidelines apply to 3-Bromo-4-(trifluoromethoxy)phenol (CAS: 886496-88-4)?

3-Bromo-4-(trifluoromethoxy)phenol (CAS: 886496-88-4) is subject to regulatory guidelines under the Globally Harmonized System of Classification and Labeling of Chemicals (GHS), the European Union Registration, Evaluation, Authorization and Restriction of Chemicals (REACH) regulations, and the regulations of the U.S. Food and Drug Administration (FDA) and Environmental Protection Agency (EPA). This compound requires appropriate hazard communication labels, safety data sheets (SDS), and may require registration and authorization under REACH.

Are there alternatives to 3-Bromo-4-(trifluoromethoxy)phenol (CAS: 886496-88-4) in synthesis?

There are alternative reagents that can be used in synthesis, such as 4-(trifluoromethoxy)phenol or brominated analogs. These alternatives can offer similar functionality but with different structural features. However, the choice of alternative depends on the specific requirements of the synthesis, including reactivity, availability, and cost.

What is the market or research trend for 3-Bromo-4-(trifluoromethoxy)phenol (CAS: 886496-88-4)?

The market for 3-Bromo-4-(trifluoromethoxy)phenol (CAS: 886496-88-4) is primarily driven by its use in pharmaceuticals and organic synthesis. Research trends indicate increasing interest in the application of this compound in drug discovery, particularly in the development of new drugs and molecular probes. The compound's unique physical and chemical properties make it valuable for various synthetic pathways and research applications.

How should waste containing 3-Bromo-4-(trifluoromethoxy)phenol (CAS: 886496-88-4) be handled?

Waste containing 3-Bromo-4-(trifluoromethoxy)phenol (CAS: 886496-88-4) should be collected in appropriate containers, labeled with the correct hazard symbols, and stored in a secure location. The waste should be disposed of through a professional waste disposal service that is licensed to handle hazardous chemicals. Incineration is a common method for disposal, provided it is conducted in an approved facility. Environmental protection measures should include the use of appropriate personal protective equipment (PPE) and adherence to local environmental regulations.