1-[4-(Benzyloxy)-3-fluorophenyl]ethanone

Basic Information

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CAS Number

81227-99-8

Molecular Formula

C15H13FO2

Molecular Weight

244.27 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

82-85

SMILES

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CC(=O)C1=CC(=C(C=C1)OCC2=CC=CC=C2)F

InChI

InChI=1S/C15H13FO2/c1-11(17)13-7-8-15(14(16)9-13)18-10-12-5-3-2-4-6-12/h2-9H,10H2,1H3

InChIKey

YLVZBSLWHNSLNP-UHFFFAOYSA-N

LogP

3.607300000000002

Topological Polar Surface Area

26.3 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

274

Safety Information

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Hazard Statement

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

DTXSID20382517
1-(4-(Benzyloxy)-3-fluorophenyl)ethanone
1-[4-(benzyloxy)-3-fluorophenyl]ethan-1-one
1-(4-(Benzyloxy)-3-fluorophenyl)ethan-1-one
J-503200
3X-0863
1-(4-benzyloxy-3-fluorophenyl)ethanone
MFCD06659550
FT-0641814
YLVZBSLWHNSLNP-UHFFFAOYSA-N
1-[4-(Benzyloxy)-3-fluorophenyl]-1-ethanone
4'-Benzyloxy-3'-fluoroacetophenone
AKOS000221434
CS-0322411
A840072
1-(3-fluoro-4-phenylmethoxyphenyl)ethanone
SCHEMBL4747320
81227-99-8
3-fluoro-4-benzyloxyacetophenone
benzyloxyfluorophenylethanone

MDL Number

MFCD06659550

FAQ

What regulatory guidelines apply to 1-[4-(Benzyloxy)-3-fluorophenyl]ethanone (CAS: 81227-99-8)?

1-[4-(Benzyloxy)-3-fluorophenyl]ethanone (CAS: 81227-99-8) falls under various regulatory guidelines including GHS classification, REACH regulations, and FDA/EPA requirements. GHS classifies this compound based on its health and environmental hazards, while REACH ensures safe production and use by requiring manufacturers to register the compound with its health and environmental effects. Additionally, FDA and EPA regulations control the import, export, and use of this chemical in the United States, ensuring compliance with safety and environmental standards.

Are there alternatives to 1-[4-(Benzyloxy)-3-fluorophenyl]ethanone (CAS: 81227-99-8) in synthesis?

There are several alternatives to 1-[4-(Benzyloxy)-3-fluorophenyl]ethanone (CAS: 81227-99-8) in synthesis, such as 1-(3-chlorophenyl)ethanone and 1-(4-fluorophenyl)ethanone. These analogs and isomers can serve as effective substitutes, depending on the specific reaction conditions and desired product properties. Common alternative reagents include benzyl alcohol and fluoroiodobenzene, which can be used in similar synthetic routes to achieve similar or different functional groups.

What is the market or research trend for 1-[4-(Benzyloxy)-3-fluorophenyl]ethanone (CAS: 81227-99-8)?

The market for 1-[4-(Benzyloxy)-3-fluorophenyl]ethanone (CAS: 81227-99-8) is influenced by its application in pharmaceuticals and agrochemicals due to its unique chemical properties. Research trends indicate a growing interest in its use as a precursor for drug synthesis and in developing new pesticides. Recent studies focus on its potential as an intermediate in organic synthesis, with a trend towards more sustainable and environmentally friendly synthetic methods. The market is expected to grow as new applications are discovered and existing ones expand.

How should waste containing 1-[4-(Benzyloxy)-3-fluorophenyl]ethanone (CAS: 81227-99-8) be handled?

Waste containing 1-[4-(Benzyloxy)-3-fluorophenyl]ethanone (CAS: 81227-99-8) should be handled with caution due to its potential health and environmental hazards. Waste liquid should be collected in appropriate containers and disposed of according to local hazardous waste regulations. Incineration or professional waste disposal services are recommended to ensure safe destruction. Environmental protection precautions include proper labeling of waste containers, adherence to safety protocols during handling, and compliance with all regulatory requirements to prevent contamination and ensure worker safety.