1-Ethynyl-4-(trifluoromethoxy)benzene

Basic Information

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CAS Number

160542-02-9

Molecular Formula

C9H5F3O

Molecular Weight

186.13 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Nitriles

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Electronic Chemicals Semiconductor Materials Etchants

Basic Physical Properties

Boiling Point

158.1°C at 760 mmHg

Refractive Index

n20/D 1.4554

SMILES

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C#CC1=CC=C(C=C1)OC(F)(F)F

InChI

InChI=1S/C9H5F3O/c1-2-7-3-5-8(6-4-7)13-9(10,11)12/h1,3-6H

InChIKey

RWWGGRCLMVYXPM-UHFFFAOYSA-N

LogP

2.56650

Complexity

205

Safety Information

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Hazard Statement

H226 Flammable liquid and vapor
Flammable liquids

H302 Harmful if swallowed
Acute toxicity, oral

H317 May cause an allergic skin reaction
Sensitization, Skin

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Hazard Class

Class 3 Class 3

Synonyms & References

English

AKOS016005970
DTXSID60380976
J-009732
1-ethynyl-4-(trifluoromethoxy)benzene
4-(TRIFLUOROMETHOXY)PHENYLACETYLENE
SY050862
1-Ethynyl-4-(trifluoromethoxy)-Benzene
A18261
PS-8484
YCWREBCXDMRXTQ-UHFFFAOYSA-N
CS-0042925
Benzene, 1-ethynyl-4-(trifluoromethoxy)-
EN300-1930968
E1170
1-ethynyl-4-(trifluoromethoxy) benzene
MFCD03094333
FT-0691043
4-(Trifluoromethoxy) phenylacetylene
1-ethynyl-4-trifluoromethoxybenzene
SCHEMBL40631
4-(Trifluoromethoxy)phenylacetylene, 97%
AB92252
160542-02-9
4-ethynylphenyl trifluoromethyl ether
1-Ethynyl-4-(trifluoromethoxy)benzene
4-(Trifluoromethoxy)phenylacetylene
Benzene,1-ethynyl-4-(trifluoromethoxy)-
1-Ethynyl-4-(trifluoromethoxy)
1-ETHYNYL-4-(TRIFLUOROMETHOXY)-BENZENE
4-ETHYNYL-1-(TRIFLUOROMETHOXY) BENZENE
1-Ethynyl-4-(trifluoromethoxy)benzene, 4-Ethynyl-alpha,alpha,alpha-trifluoroanisole

MDL Number

MFCD03094333

Customs Code

2909309090

FAQ

What regulatory guidelines apply to 1-Ethynyl-4-(trifluoromethoxy)benzene (CAS: 160542-02-9)?

1-Ethynyl-4-(trifluoromethoxy)benzene (CAS: 160542-02-9) is subject to various regulatory guidelines. It falls under the classification of a hazardous chemical under the Globally Harmonized System of Classification and Labeling of Chemicals (GHS). In the European Union, it is regulated under the REACH regulations. For use in the United States, it is managed by the EPA and may require specific handling and storage guidelines. Additionally, the FDA has specific requirements for the use of this compound in any pharmaceutical applications.

Are there alternatives to 1-Ethynyl-4-(trifluoromethoxy)benzene in synthesis (CAS: 160542-02-9)?

For the synthesis of 1-Ethynyl-4-(trifluoromethoxy)benzene (CAS: 160542-02-9), chemists may consider using similar aromatic compounds such as 4-(trifluoromethoxy)benzaldehyde or 4-(trifluoromethoxy)benzoyl chloride as alternatives. These compounds can serve similar functions in certain synthetic schemes, providing options for researchers and manufacturers.

What is the market or research trend for 1-Ethynyl-4-(trifluoromethoxy)benzene (CAS: 160542-02-9)?

The market for 1-Ethynyl-4-(trifluoromethoxy)benzene (CAS: 160542-02-9) is driven by its application in organic synthesis and pharmaceuticals. Current research trends focus on its use as a key intermediate in the development of novel drugs and materials. Industry demand is expected to grow with advancements in medicinal chemistry and the need for new functional compounds in various industries.

How should waste containing 1-Ethynyl-4-(trifluoromethoxy)benzene (CAS: 160542-02-9) be handled?

Waste containing 1-Ethynyl-4-(trifluoromethoxy)benzene (CAS: 160542-02-9) should be collected and disposed of in accordance with local and international hazardous waste regulations. Waste liquids should be neutralized and contained before disposal. For solid waste, it should be placed in appropriate containers and transported to a professional hazardous waste disposal facility. Proper environmental protection measures should be taken to prevent contamination of soil and water sources.