4-Bromo-7-fluoro-1-indanone

Basic Information

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CAS Number

1003048-72-3

Molecular Formula

C9H6BrFO

Molecular Weight

229.05 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

SMILES

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C1CC(=O)C2=C(C=CC(=C21)Br)F

InChI

InChI=1S/C9H6BrFO/c10-6-2-3-7(11)9-5(6)1-4-8(9)12/h2-3H,1,4H2

InChIKey

HNXHWYGTXAJDEC-UHFFFAOYSA-N

LogP

2.717100000000001

Topological Polar Surface Area

17.07 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

207

Synonyms & References

English

FT-0766613
1003048-72-3
MFCD17677340
BCP25575
AKOS016008106
SY102867
HNXHWYGTXAJDEC-UHFFFAOYSA-N
1H-Inden-1-one, 4-bromo-7-fluoro-2,3-dihydro-
4-Bromo-7-fluoroindan-1-one
4-Bromo-7-fluoro-1-indanone
CS-W022116
4-Bromo-7-fluoro-2,3-dihydro-1-indanone
SCHEMBL12261417
4-bromo-7-fluoro-2,3-dihydroinden-1-one
4-Bromo-7-fluoro-indan-1-one
4-Bromo-7-fluoro-2,3-dihydro-1H-inden-1-one
DTXSID30702404
4-Bromo-7-fluoro-2 pound not3-dihydro-1H-inden-1-one
AM8848
DS-4414
4-?Bromo-?7-?fluoro-?2,?3-?dihydro-?1H-?inden-?1-?one
4-broMo-7-fluoro-2,3-dihydroinden-1-one
AK104893
ANW-70893
BD239101
CTK8C3977
QC-10822
4-Bromo-2,3-dihydro-7-fluoro-1H-inden-1-one, 4-Bromo-2,3-dihydro-7-fluoro-1-oxo-1H-indene
AMOT0460
AB0043929
Z1896

MDL Number

MFCD17677340

FAQ

What are the physical and chemical properties of 4-Bromo-7-fluoro-1-indanone (CAS: 1003048-72-3)?

4-Bromo-7-fluoro-1-indanone (CAS: 1003048-72-3) is a crystalline compound with a molecular weight of approximately 265.04 g/mol. It has a low solubility in water but is more soluble in organic solvents such as dichloromethane and acetone. Chemically, it shows limited reactivity, primarily undergoing nucleophilic substitution reactions due to the presence of the bromo and fluoro substituents.

How is 4-Bromo-7-fluoro-1-indanone (CAS: 1003048-72-3) typically synthesized?

4-Bromo-7-fluoro-1-indanone can be synthesized via a multi-step protocol. A common approach involves the bromination of 7-fluoro-1-indanone followed by selective ring substitution. This process typically employs N-bromosuccinimide (NBS) as the brominating agent and an organic solvent like dichloromethane. The yield and selectivity can be enhanced with appropriate catalytic systems and reaction conditions.

What industries use 4-Bromo-7-fluoro-1-indanone (CAS: 1003048-72-3)?

4-Bromo-7-fluoro-1-indanone (CAS: 1003048-72-3) is primarily used in the pharmaceutical industry for the preparation of bioactive compounds and in polymer synthesis for developing advanced materials. It also finds applications in sensor technology for its unique spectroscopic properties and in semiconductor industries due to its electronic structure.

What precautions should be taken when handling 4-Bromo-7-fluoro-1-indanone (CAS: 1003048-72-3)?

When handling 4-Bromo-7-fluoro-1-indanone (CAS: 1003048-72-3), it is crucial to wear appropriate personal protective equipment (PPE) including gloves, safety goggles, and a lab coat. Work should be conducted in a well-ventilated area or a fume hood to minimize exposure. Spills should be managed carefully, and appropriate safety data sheets (SDS) should be referenced for specific instructions. Ensure proper disposal and storage to prevent environmental contamination.